cis-3,4-Phenanthrenedihydrodiol-4-carboxylate (CHEBI:81607)

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ChEBI Name	cis-3,4-Phenanthrenedihydrodiol-4-carboxylate

ChEBI ID	CHEBI:81607

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C15H12O4

Net Charge

Average Mass

256.25340

Monoisotopic Mass

256.07356

InChI

InChI=1S/C15H12O4/c16-12-8-7-10-6-5-9-3-1-2-4-11(9)13(10)15(12,19)14(17)18/h1-8,12,16,19H,(H,17,18)/t12-,15-/m1/s1

InChIKey

WBAZPUVNIAXCFM-IUODEOHRSA-N

SMILES

O[C@@H]1C=Cc2ccc3ccccc3c2[C@@]1(O)C(O)=O

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 )

ChEBI Ontology
Outgoing	cis-3,4-Phenanthrenedihydrodiol-4-carboxylate (CHEBI:81607) is a phenanthrol (CHEBI:25962)