Consensus flow list

Identity

Type
NeutralMolecule
CAS
82-28-0
EC
201-408-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 1-amino-2-methyl-9,10-anthracenedione

Alternative labels

22

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZLCUIOWQYBYEBG-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C15H11NO2/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7H,16H2,1H3
IUPAC name chemrof:IUPAC_name 1-amino-2-methyl-9,10-anthracenedione
Molecular formula chemrof:molecular_formula C15H11NO2
Molecular mass chemrof:molecular_mass 237.258
Monoisotopic mass chemrof:monoisotopic_mass 237.078979, 237.07898
SMILES string chemrof:smiles_string Cc1ccc2c(c1N)C(=O)c1ccccc1C2=O

Known URLs

16

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=82-28-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:82382 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.001.281 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID7020057 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=39943 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=667744 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1413787 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/RHN157F30Q enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0243816 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.610H enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C19320 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C19320 enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C44302 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/6702 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=069349 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q27155911 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
e2fb2bc7-6555-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1cc-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
09bd63e0-8fe8-4bfc-b7f7-f2332d646da3 Environmental → Air → Indoor EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1cb-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a1cd-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1ca-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1c8-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-9593-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1c9-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1cf-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-9594-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
fe0acd60-3ddc-11dd-a1ce-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
4d9a8790-3ddd-11dd-9592-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-48c7d7330de4fd02",
  "prefLabel": [
    {
      "@value": "1-amino-2-methyl-9,10-anthracenedione",
      "@language": "en",
      "@lang": "en",
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
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      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1-Amino-2-methylanthraquinone",
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      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methyl-1-anthraquinonylamine",
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      }
    },
    {
      "@value": "9,10-Anthracenedione, 1-amino-2-methyl-",
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      }
    },
    {
      "@value": "Acetate Fast Orange R",
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    {
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    {
      "@value": "Anthraquinone, 1-amino-2-methyl-",
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    {
      "@value": "Artisil Orange 3RP",
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    {
      "@value": "C.I. Disperse Orange 11",
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    {
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    },
    {
      "@value": "Celliton Orange R",
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      "@lang": "en",
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    },
    {
      "@value": "Cilla Orange R",
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    },
    {
      "@value": "Disperse Orange (anthraquinone dye)",
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    },
    {
      "@value": "Duranol Orange G",
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      "@value": "Microsetile Orange RA",
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    },
    {
      "@value": "Nyloquinone Orange JR",
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    {
      "@value": "Perliton Orange 3R",
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    },
    {
      "@value": "Serisol Orange YL",
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    {
      "@value": "Smoke Orange LK 6044",
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      "@value": "Solvent Orange 35",
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    {
      "@value": "Supracet Orange R",
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  ],
  "properties": {
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      "@value": [
        "C15H11NO2"
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      "rdfs:label": "Molecular formula",
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