Hynapene C (CHEBI:200593)

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CHEBI:200593 - Hynapene C

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ChEBI ID	CHEBI:200593
ChEBI Name	Hynapene C
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H24O3
Net Charge	0
Average Mass	288.387
Monoisotopic Mass	288.17254
SMILES	CC1CC(C)C2C(=O)C(C)(/C=C/C=C/C(=O)O)C=CC2C1
InChI	InChI=1S/C18H24O3/c1-12-10-13(2)16-14(11-12)7-9-18(3,17(16)21)8-5-4-6-15(19)20/h4-9,12-14,16H,10-11H2,1-3H3,(H,19,20)/b6-4+,8-5+
InChIKey	NUIMPRVESYOKAD-HLQBBKRNSA-N

Species of Metabolite	Component	Source	Comments
Penicillium (ncbitaxon:5073)	-	PubMed (8294243)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Hynapene C (CHEBI:200593) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
(2E,4E)-5-(2,6,8-trimethyl-1-oxo-4a,5,6,7,8,8a-hexahydronaphthalen-2-yl)penta-2,4-dienoic acid

Manual Xrefs	Databases
4947684	ChemSpider