1,7,8-trihydroxy-3-methyl-1,2,3,4,7,12-hexahydrotetraphen-12-one (CHEBI:192588)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	1,7,8-trihydroxy-3-methyl-1,2,3,4,7,12-hexahydrotetraphen-12-one

ChEBI ID	CHEBI:192588

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H18O4

Net Charge

Average Mass

310.349

Monoisotopic Mass

310.12051

InChI

InChI=1S/C19H18O4/c1-9-7-10-5-6-12-17(15(10)14(21)8-9)19(23)11-3-2-4-13(20)16(11)18(12)22/h2-6,9,14,18,20-22H,7-8H2,1H3

InChIKey

FDVOVSCQDWKKHH-UHFFFAOYSA-N

SMILES

OC1CC(CC2=C1C3=C(C(O)C4=C(C3=O)C=CC=C4O)C=C2)C

Metabolite of Species	Details
Valsa sordida (NCBI:txid252740)	Found in Whole Organism (NCIT:C13413). See: MetaboLights Study

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	1,7,8-trihydroxy-3-methyl-1,2,3,4,7,12-hexahydrotetraphen-12-one (CHEBI:192588) is a phenanthrol (CHEBI:25962)

IUPAC Name

1,7,8-trihydroxy-3-methyl-2,3,4,7-tetrahydro-1H-benzo[a]anthracen-12-one