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CHEBI:69278 - coscinoquinol, (rel)-

ChEBI IDCHEBI:69278
ChEBI Namecoscinoquinol, (rel)-
Stars
DefinitionA natural product found in Coscinoderma species.
Last Modified22 September 2014
DownloadsMolfile
FormulaC31H46O2
Net Charge0
Average Mass450.707
Monoisotopic Mass450.34978
SMILES[H][C@@]12CC=C(C)[C@H](C/C=C(/C)CCC/C(C)=C/Cc3cc(O)ccc3O)[C@@]1(C)CCCC2(C)C
InChIInChI=1S/C31H46O2/c1-22(11-14-25-21-26(32)15-17-28(25)33)9-7-10-23(2)12-16-27-24(3)13-18-29-30(4,5)19-8-20-31(27,29)6/h11-13,15,17,21,27,29,32-33H,7-10,14,16,18-20H2,1-6H3/b22-11+,23-12-/t27-,29-,31+/m0/s1
InChIKeyFBBXOWQBMFRXRO-MEVHTVKHSA-N
Species of MetaboliteComponentSourceComments
Coscinoderma (ncbitaxon:1162776) - PubMed (21827183) Methanol and methylene dichloride extract of lyophilized and macerated sponge
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
coscinoquinol, (rel)- (CHEBI:69278) has role metabolite (CHEBI:25212)
coscinoquinol, (rel)- (CHEBI:69278) is a sesterterpenoid (CHEBI:26660)
Synonym  Source
rel-2-{(2E,7Z)-3,7-Dimethyl-9-[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]-2,7-nonadien-1-yl}-1,4-benzenedioChEBI
Manual XrefsDatabases
9919207ChemSpider
Citations