Nectriacid A (CHEBI:211992)

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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 A

ChEBI ID	CHEBI:211992

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H18O4

Net Charge

Average Mass

262.305

Monoisotopic Mass

262.12051

InChI

InChI=1S/C15H18O4/c1-11(7-8-14(16)17)5-4-6-12(2)9-13(3)10-15(18)19/h4-10H,1-3H3,(H,16,17)(H,18,19)/b6-4+,8-7+,11-5+,12-9+,13-10+

InChIKey

ZUFWMVGBPCQMRJ-ORXCQCOUSA-N

SMILES

O=C(O)/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 A (CHEBI:211992) is a monoterpenoid (CHEBI:25409)

IUPAC Name

(2E,4E,6E,8E,10E)-3,5,9-trimethyldodeca-2,4,6,8,10-pentaenedioic acid