CHEBI:82559 - 7-Hydroxymethyl-12-methylbenz[a]anthracene

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ChEBI Name 7-Hydroxymethyl-12-methylbenz[a]anthracene
ChEBI ID CHEBI:82559
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H16O
Net Charge 0
Average Mass 272.34040
Monoisotopic Mass 272.12012
InChI InChI=1S/C20H16O/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16(14)20(13)18/h2-11,21H,12H2,1H3
InChIKey JCBBZYDVQJQMMB-UHFFFAOYSA-N
SMILES Cc1c2ccccc2c(CO)c2ccc3ccccc3c12
Roles Classification
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
(via phenanthrenes )
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ChEBI Ontology
Outgoing 7-Hydroxymethyl-12-methylbenz[a]anthracene (CHEBI:82559) is a phenanthrenes (CHEBI:25961)
Synonym Source
12-Methylbenz[a]anthracene-7-methanol KEGG COMPOUND
Manual Xrefs Databases
C19561 KEGG COMPOUND
HMDB0060419 HMDB
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Registry Number Type Source
568-75-2 CAS Registry Number KEGG COMPOUND