Consensus flow list

Identity

Type
Neutral molecule
CAS
846-50-4
EC
212-688-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Temazepam

Alternative labels

31

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string SEQDDYPDSLOBDC-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3
IUPAC name chemrof:IUPAC_name 1-Methyl-3-hydroxy-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Molecular formula chemrof:molecular_formula C16H13ClN2O2
Molecular mass chemrof:molecular_mass 300.745
Monoisotopic mass chemrof:monoisotopic_mass 300.066555, 300.06656
SMILES string chemrof:smiles_string CN1C(=O)C(O)N=C(c2ccccc2)c2cc(Cl)ccc21

Known URLs

25

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=846-50-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:9435 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.011.535 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID8021309 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB00231 enrich_references.pubchem_identifier_url
drugcentral drugcentral:2585 enrich_references.chebi_xrefs
drugcentral.org https://drugcentral.org/drugcard/2585 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=246303 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL967 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/CHB1QD2QSS enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0014376 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.138B enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C07125 enrich_references.chebi_xrefs
KEGG https://www.genome.jp/entry/D00370 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C07125 enrich_references.pubchem_identifier_url
kegg.jp https://www.kegg.jp/entry/D00370 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=42633 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C29488 enrich_references.pubchem_identifier_url
pharmgkb.org https://www.pharmgkb.org/chemical/PA451608 enrich_references.pubchem_identifier_url
pharos.nih.gov https://pharos.nih.gov/ligands/Q4CA3TGL2PVD enrich_references.pubchem_identifier_url
platform.opentargets.org https://platform.opentargets.org/drug/CHEMBL967 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/5391 enrich_references.pubchem_compound
rxnav.nlm.nih.gov https://rxnav.nlm.nih.gov/id/rxnorm/10355 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q414796 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Temazepam enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
3aeee95a-5b9f-4999-b601-1de41cb0fec2 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
a8198043-88f8-40f3-89d5-560e8abf3b86 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
a7a2d05a-4b61-4177-a86d-6ec0614dbebe Environmental → Air → Indoor EF 3.1 kg 0
72301149-9c0d-40c9-984f-ffde001ceea5 Environmental → Air → Long-term EF 3.1 kg 0
cbbb8ade-bb49-4d1b-9c16-9081f2ccf709 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
0961ea8b-7bdc-438e-9944-a3cb4a0c5df2 Environmental → Air → Unknown EF 3.1 kg 0
4e5db0fa-070c-4589-88a4-28f75ecdb97a Environmental → Ground → Agricultural EF 3.1 kg 0
cc19094b-079a-4fbc-9e39-5c6dd2e922fe Environmental → Ground → Non-agricultural EF 3.1 kg 0
e2d64ed1-405d-4204-be2c-f892deece1b1 Environmental → Ground → Unknown EF 3.1 kg 0
ff7ce704-445a-4ea3-9080-9848a01b4c22 Environmental → Water → Long-term EF 3.1 kg 0
a3551e6a-64a9-44de-b73f-b3e51f7f4d61 Environmental → Water → Ocean EF 3.1 kg 0
8d9b1db5-12be-402b-908f-a99100042488 Environmental → Water → Surface water EF 3.1 kg 0
217aea75-7262-40d0-b64f-cda0ccad333b Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-fa4f5b797ae18b01",
  "prefLabel": [
    {
      "@value": "Temazepam",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "(RS)-Temazepam",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "(±)-Temazepam",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "1-Methyl-3-hydroxy-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one",
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    },
    {
      "@value": "2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-3-hydroxy-1-methyl-5-phenyl-",
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    },
    {
      "@value": "3-Hydroxydiazepam",
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    },
    {
      "@value": "7-Chloro-1,3-dihydro-1-methyl-3-hydroxy-5-phenyl-2H-1,4-benzodiazepin-2-one",
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      "@value": "7-Chloro-3-hydroxy-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine",
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      "@value": "Crisonar",
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    },
    {
      "@value": "Euhypnos",
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      }
    },
    {
      "@value": "Euipnos",
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    },
    {
      "@value": "Gelthix",
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    },
    {
      "@value": "levanxene",
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    },
    {
      "@value": "levanxol",
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    },
    {
      "@value": "MeSH ID: D013693",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methyloxazepam",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "N-Methyloxazepam",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Normison",
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    },
    {
      "@value": "Oxydiazepam",
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      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=846-50-4"
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Perdorm",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Planum",
      "@language": "en",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Racemic temazepam",
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    },
    {
      "@value": "Remestan",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Restoril",
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      "provenance": {
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      }
    },
    {
      "@value": "Restoril (TN)",
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      }
    },
    {
      "@value": "Ro 5-5345",
      "@language": "en",
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      "provenance": {
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    },
    {
      "@value": "Ro 5-5354",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Signopam",
      "@language": "en",
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      "provenance": {
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
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    },
    {
      "@value": "Tenox",
      "@language": "en",
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    },
    {
      "@value": "Tenox (pharmaceutical)",
      "@language": "en",
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  ],
  "properties": {
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    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
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