(4R,5R,7R,8R)-eremophil-9-ene-4,8,11-triol (CHEBI:215983)

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CHEBI:215983 - (4R,5R,7R,8R)-eremophil-9-ene-4,8,11-triol

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ChEBI ID	CHEBI:215983
ChEBI Name	(4R,5R,7R,8R)-eremophil-9-ene-4,8,11-triol
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Submitter	MetaboLights
Downloads	Molfile

Formula	C15H26O3
Net Charge	0
Average Mass	254.370
Monoisotopic Mass	254.18819
SMILES	CC(C)(O)[C@@H]1C[C@]2(C)C(=C[C@H]1O)CCC[C@@]2(C)O
InChI	InChI=1S/C15H26O3/c1-13(2,17)11-9-14(3)10(8-12(11)16)6-5-7-15(14,4)18/h8,11-12,16-18H,5-7,9H2,1-4H3/t11-,12-,14-,15-/m1/s1
InChIKey	UQRWFXHGOXVIPI-QHSBEEBCSA-N

Species of Metabolite	Component	Source	Comments
Botrytis cinerea (ncbitaxon:40559)	-	PubMed (29929021)

ChEBI Ontology

Outgoing Relation(s)
	(4R,5R,7R,8R)-eremophil-9-ene-4,8,11-triol (CHEBI:215983) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
(1R,6R,7R,8aR)-7-(2-hydroxypropan-2-yl)-1,8a-dimethyl-2,3,4,6,7,8-hexahydronaphthalene-1,6-diol

Manual Xrefs	Databases
78443466	ChemSpider