Consensus flow list

Testosterone

fo-35e94c805d398df4

Identity

Type
Neutral molecule
CAS
58-22-0
EC
200-370-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Testosterone

This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.

Alternative labels

73

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string MUMGGOZAMZWBJJ-DYKIIFRCSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1
Isomeric SMILES string chemrof:isomeric_smiles_string C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O
IUPAC name chemrof:IUPAC_name 17beta-Hydroxy-4-androsten-3-one
Molecular formula chemrof:molecular_formula C19H28O2
Molecular mass chemrof:molecular_mass 288.431
Monoisotopic mass chemrof:monoisotopic_mass 288.20893
SMILES string chemrof:smiles_string CC12CCC(=O)C=C1CCC1C2CCC2(C)C(O)CCC12

Known URLs

38

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
beilstein beilstein:3653705 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=58-22-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:17347 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.000.336 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8022371 enrich_references.pubchem_identifier_url
DrugBank https://go.drugbank.com/drugs/DB00624 enrich_references.chebi_xrefs
drugbank.ca https://www.drugbank.ca/drugs/DB00624 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2607 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2607 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL386630 enrich_references.pubchem_identifier_url
gmelin gmelin:538843 enrich_references.chebi_xrefs
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3XMK78S47O enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0000234 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.590J enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C00535 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D00075 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C00535 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D00075 enrich_references.pubchem_identifier_url
knapsack knapsack:C00003675 enrich_references.chebi_xrefs
LIPID MAPS https://www.lipidmaps.org/databases/lmsd/LMST02020002 enrich_references.chebi_xrefs
lipidmaps.org https://lipidmaps.org/databases/lmsd/LMST02020002 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=35313 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C2299 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C862 enrich_references.pubchem_identifier_url
pdb-ccd pdb-ccd:TES enrich_references.chebi_xrefs
pharmgkb.org https://www.pharmgkb.org/chemical/PA451627 enrich_references.pubchem_identifier_url
pharos.nih.gov https://pharos.nih.gov/ligands/FSPU2JHZJDPZ enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL386630 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6013 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=070519 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/10438974 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/11786693 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/18900503 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24498482 enrich_references.chebi_xrefs
reaxys reaxys:1915399 enrich_references.chebi_xrefs
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/10379 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q1318776 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Testosterone enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
4ffa5578-dead-4d1c-b741-1bac5e080327 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
1b725917-2035-4bd0-81b9-c93eb333d1a9 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
7a2520b7-c8b8-4800-926c-82f6754c71f6 Environmental → Air → Indoor EF 3.1 kg 2
c80bb4f3-f62d-4c37-9aca-077ebf64d82a Environmental → Air → Long-term EF 3.1 kg 0
151ab497-c434-4c87-a04b-6b02520e149e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
7a2665e7-1082-42ff-87b6-abc5d7ef37d0 Environmental → Air → Unknown EF 3.1 kg 2
5f83f113-df0a-44e8-b07d-9fe6dc47700d Environmental → Ground → Agricultural EF 3.1 kg 2
d03b5460-79e7-4740-bf3e-4a56edfba60d Environmental → Ground → Non-agricultural EF 3.1 kg 2
a1323b92-6829-4da1-bb38-f813cdfe29b8 Environmental → Ground → Unknown EF 3.1 kg 2
96b37dcc-ba75-4602-b497-edc9c7ea98f6 Environmental → Water → Long-term EF 3.1 kg 0
47bb0357-15df-423d-a4e9-fae924bbdfe9 Environmental → Water → Ocean EF 3.1 kg 2
6aecf536-b952-4ea6-bd29-b3fed1d1b8fd Environmental → Water → Surface water EF 3.1 kg 2
0f77643c-a513-4f47-9be1-bef1b5f992ad Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-35e94c805d398df4",
  "prefLabel": [
    {
      "@value": "Testosterone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(+)-Testosterone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "(17β)-17-Hydroxyandrost-4-en-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "(8R,9S,10R,13S,14S,17S)-17-Hydroxy-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "17beta-Hydroxy-4-androsten-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17347"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "17beta-hydroxyandrost-4-en-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17347"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "17β-Hydroxy-Δ4-androsten-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "17β-Hydroxyandrost-4-en-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "17β-Hydroxyandrost-4-ene-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "17β-Testosterone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "4-androsten-17beta-ol-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17347"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "4-Androsten-3-one-17β-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Androderm",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1",
          "http://purl.obolibrary.org/obo/CHEBI_17347"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "AndroForte 5",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "AndroGel",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Androlin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Andronaq",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Andropatch",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Androst-4-en-17β-ol-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Androst-4-en-3-one, 17-hydroxy-, (17β)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Androst-4-ene-17β-ol-3-one",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Andrusol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Axiron",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Compleo",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Cristerona T",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Geno-cristaux Gremy",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Glowmin",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Homosteron",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Homosterone",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Intrinsa",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Livensa",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mertestate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "MeSH ID: D013739",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:58-22-0",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nasobol",
      "@language": "en",
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    "seed_source": "EF 3.1",
    "semantic_typing": {
      "rule": "neutral_molecule",
      "reason": "",
      "types": [
        "https://w3id.org/chemrof/NeutralMolecule"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "semantic_typing.classify",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
      }
    }
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "58-22-0"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=58-22-0"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "200-370-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=200-370-5"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "http://www.w3.org/2004/02/skos/core#definition": [
    {
      "@value": "An androstanoid having 17β-hydroxy and 3-oxo groups, together with unsaturation at C-4‒C-5..",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_17347"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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