9,10-diolhinokiic acid (CHEBI:213419)

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CHEBI:213419 - 9,10-diolhinokiic acid

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ChEBI ID	CHEBI:213419
ChEBI Name	9,10-diolhinokiic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H22O4
Net Charge	0
Average Mass	266.337
Monoisotopic Mass	266.15181
SMILES	CC1(C)[C@H](O)[C@H](O)C[C@@]2(C)CC=C(C(=O)O)[C@@H]3C[C@]312
InChI	InChI=1S/C15H22O4/c1-13(2)11(17)10(16)7-14(3)5-4-8(12(18)19)9-6-15(9,13)14/h4,9-11,16-17H,5-7H2,1-3H3,(H,18,19)/t9-,10+,11+,14+,15-/m0/s1
InChIKey	XTUOMMWRCSZFGR-ILYYPIBPSA-N

Species of Metabolite	Component	Source	Comments
Talaromyces purpureogenus (ncbitaxon:1266744)	-	PubMed (29724060)

ChEBI Ontology

Outgoing Relation(s)
	9,10-diolhinokiic acid (CHEBI:213419) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
(1aR,4aR,6R,7S,8aR)-6,7-dihydroxy-4a,8,8-trimethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene-2-carboxylic acid

Manual Xrefs	Databases
65328915	ChemSpider