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CHEBI:217389 - Aspewentin C

ChEBI IDCHEBI:217389
ChEBI NameAspewentin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H26O2
Net Charge0
Average Mass286.415
Monoisotopic Mass286.19328
SMILESC=C[C@@]1(C)CCC2=C(C1)C(=O)C=C1C(C)(C)CCC[C@@]12O
InChIInChI=1S/C19H26O2/c1-5-18(4)10-7-14-13(12-18)15(20)11-16-17(2,3)8-6-9-19(14,16)21/h5,11,21H,1,6-10,12H2,2-4H3/t18-,19-/m0/s1
InChIKeyMMWGIGCGTHYFEV-OALUTQOASA-N
Species of MetaboliteComponentSourceComments
Aspergillus wentii (ncbitaxon:5066) - PubMed (24499164)
Roles Classification
Biological Role:
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.
ChEBI Ontology
Outgoing Relation(s)
Aspewentin C (CHEBI:217389) is a phenanthrenes (CHEBI:25961)
IUPAC Name 
(4aS,7S)-7-ethenyl-4a-hydroxy-1,1,7-trimethyl-2,3,4,5,6,8-hexahydrophenanthren-9-one
Manual XrefsDatabases
32674719ChemSpider