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CHEBI:67721 - Officinoic acid B

ChEBI IDCHEBI:67721
ChEBI NameOfficinoic acid B
Stars
DefinitionA natural product found in Spongia officinalis.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H38O4
Net Charge0
Average Mass366.542
Monoisotopic Mass366.27701
SMILESCCCCCCC/C(C)=C\C(=O)OC(C)CCCC/C=C(/C)CC(=O)O
InChIInChI=1S/C22H38O4/c1-5-6-7-8-10-14-19(3)17-22(25)26-20(4)15-12-9-11-13-18(2)16-21(23)24/h13,17,20H,5-12,14-16H2,1-4H3,(H,23,24)/b18-13-,19-17-
InChIKeyGUGWWNGSTOHWGD-MAFYCXDASA-N
Species of MetaboliteComponentSourceComments
Spongia officinalis (ncbitaxon:252964) - PubMed (21548580) Diethyl ether soluble portion of acetone extract of chopped, frozen 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)
Officinoic acid B (CHEBI:67721) has role metabolite (CHEBI:25212)
Officinoic acid B (CHEBI:67721) is a fatty acid ester (CHEBI:35748)
Synonym  Source
(Z)-3-methyl-9-[(Z)-3-methyldec-2-enoyl]oxydec-3-enoic acidChEBI
Citations