(4S,5S,7R,8R)-eremophil-9-ene-8,11-diol (CHEBI:215973)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:215973 - (4S,5S,7R,8R)-eremophil-9-ene-8,11-diol

Take structure to advanced search

ChEBI ID	CHEBI:215973
ChEBI Name	(4S,5S,7R,8R)-eremophil-9-ene-8,11-diol
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C15H26O2
Net Charge	0
Average Mass	238.371
Monoisotopic Mass	238.19328
SMILES	C[C@H]1CCCC2=C[C@@H](O)[C@H](C(C)(C)O)C[C@]21C
InChI	InChI=1S/C15H26O2/c1-10-6-5-7-11-8-13(16)12(14(2,3)17)9-15(10,11)4/h8,10,12-13,16-17H,5-7,9H2,1-4H3/t10-,12+,13+,15-/m0/s1
InChIKey	VYLHYKHUCVHIKW-ZGFBFQLVSA-N

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

ChEBI Ontology

Outgoing Relation(s)
	(4S,5S,7R,8R)-eremophil-9-ene-8,11-diol (CHEBI:215973) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
(2R,3R,4aS,5S)-3-(2-hydroxypropan-2-yl)-4a,5-dimethyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-ol

Manual Xrefs	Databases
78443464	ChemSpider