Nectriacid C (CHEBI:212003)

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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	Nectriacid C

ChEBI ID	CHEBI:212003

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H20O4

Net Charge

Average Mass

276.332

Monoisotopic Mass

276.13616

InChI

InChI=1S/C16H20O4/c1-12(8-9-16(19)20-4)6-5-7-13(2)10-14(3)11-15(17)18/h5-11H,1-4H3,(H,17,18)/b7-5+,9-8+,12-6+,13-10-,14-11+

InChIKey

ODVDUKZVQSCKTM-XLBOAADXSA-N

SMILES

O=C(OC)/C=C/C(=C/C=C/C(=C\C(=C\C(=O)O)\C)/C)/C

Metabolite of Species	Details
Nectriaspecies HN001 (NCBI:txid1856692)	See: PubMed

ChEBI Ontology
Outgoing	Nectriacid C (CHEBI:212003) is a monoterpenoid (CHEBI:25409)

IUPAC Name

(2E,4Z,6E,8E,10E)-12-methoxy-3,5,9-trimethyl-12-oxododeca-2,4,6,8,10-pentaenoic acid