CHEBI:67720 - Officinoic acid A

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ChEBI Name Officinoic acid A
ChEBI ID CHEBI:67720
Definition A natural product found in Spongia officinalis.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H36O4
Net Charge 0
Average Mass 340.49740
Monoisotopic Mass 340.26136
InChI InChI=1S/C20H36O4/c1-5-6-7-8-10-17(3)14-20(23)24-15-18(4)12-9-11-16(2)13-19(21)22/h14,16,18H,5-13,15H2,1-4H3,(H,21,22)/b17-14-
InChIKey HPMCDJQPMNPVHR-VKAVYKQESA-N
SMILES CCCCCC\C(C)=C/C(=O)OCC(C)CCCC(C)CC(O)=O
Metabolite of Species Details
Spongia officinalis (NCBI:txid252964) Diethyl ether soluble portion of acetone extract of chopped, frozen sponge See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Officinoic acid A (CHEBI:67720) has role metabolite (CHEBI:25212)
Officinoic acid A (CHEBI:67720) is a fatty acid ester (CHEBI:35748)
Synonym Source
3,7-dimethyl-8-[(Z)-3-methylnon-2-enoyl]oxyoctanoic acid ChEBI
Citation Waiting for Citations Type Source
21548580 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:dicarboxylic acid(CHEBI:35692); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:carboxylic acid(CHEBI:33575); ISA:ether(CHEBI:25698); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586);