Methyl 3,7-dihydroxy-15-cycloneranate (CHEBI:208316)

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CHEBI:208316 - Methyl 3,7-dihydroxy-15-cycloneranate

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ChEBI ID	CHEBI:208316
ChEBI Name	Methyl 3,7-dihydroxy-15-cycloneranate
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H30O4
Net Charge	0
Average Mass	286.412
Monoisotopic Mass	286.21441
SMILES	COC(=O)C(C)CCC[C@@](C)(O)[C@@H]1CC[C@@](C)(O)[C@H]1C
InChI	InChI=1S/C16H30O4/c1-11(14(17)20-5)7-6-9-16(4,19)13-8-10-15(3,18)12(13)2/h11-13,18-19H,6-10H2,1-5H3/t11?,12-,13+,15+,16+/m0/s1
InChIKey	HRHABFVVFDETJB-BTVFNWTGSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma (ncbitaxon:5543)	-	PubMed (30351930)

ChEBI Ontology

Outgoing Relation(s)
	Methyl 3,7-dihydroxy-15-cycloneranate (CHEBI:208316) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
methyl (6R)-6-hydroxy-6-[(1R,2S,3R)-3-hydroxy-2,3-dimethylcyclopentyl]-2-methylheptanoate

Manual Xrefs	Databases
70962813	ChemSpider