Tanzawaic acid L (CHEBI:212019)

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CHEBI:212019 - Tanzawaic acid L

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ChEBI ID	CHEBI:212019
ChEBI Name	Tanzawaic acid L
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H24O3
Net Charge	0
Average Mass	288.387
Monoisotopic Mass	288.17254
SMILES	CC1=C(/C=C/C=C/C(=O)O)[C@H]2[C@H](C)C[C@@](C)(O)C[C@@H]2C=C1
InChI	InChI=1S/C18H24O3/c1-12-8-9-14-11-18(3,21)10-13(2)17(14)15(12)6-4-5-7-16(19)20/h4-9,13-14,17,21H,10-11H2,1-3H3,(H,19,20)/b6-4+,7-5+/t13-,14+,17+,18-/m1/s1
InChIKey	WJCBQWQBAVQDHU-YIBCINBSSA-N

Species of Metabolite	Component	Source	Comments
Penicillium (ncbitaxon:5073)	-	PubMed (24605144)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Tanzawaic acid L (CHEBI:212019) is a medium-chain fatty acid (CHEBI:59554)

IUPAC Name
(2E,4E)-5-[(4aR,6R,8R,8aS)-6-hydroxy-2,6,8-trimethyl-5,7,8,8a-tetrahydro-4aH-naphthalen-1-yl]penta-2,4-dienoic acid

Manual Xrefs	Databases
78443510	ChemSpider