(4R*, 5S*, 6S*, 8S*, 13R*)-1-(2,8-dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydro-naphthalen-1-yl)-3-methoxy-propan-1-one (CHEBI:212473)

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CHEBI:212473 - (4R, 5S, 6S, 8S, 13R*)-1-(2,8-dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydro-naphthalen-1-yl)-3-methoxy-propan-1-one

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ChEBI ID	CHEBI:212473
ChEBI Name	(4R, 5S, 6S, 8S, 13R*)-1-(2,8-dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydro-naphthalen-1-yl)-3-methoxy-propan-1-one
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C17H26O4
Net Charge	0
Average Mass	294.391
Monoisotopic Mass	294.18311
SMILES	COCCC(=O)[C@]1(C)[C@@H]2C(=C[C@@H](C)C[C@@H]2O)C=C[C@@]1(C)O
InChI	InChI=1S/C17H26O4/c1-11-9-12-5-7-16(2,20)17(3,14(19)6-8-21-4)15(12)13(18)10-11/h5,7,9,11,13,15,18,20H,6,8,10H2,1-4H3/t11-,13+,15-,16-,17-/m1/s1
InChIKey	GOIFPEJPOWNBLP-FAWFFBBMSA-N

ChEBI Ontology

Outgoing Relation(s)
	(4R, 5S, 6S, 8S, 13R)-1-(2,8-dihydroxy-1,2,6-trimethyl-1,2,6,7,8,8a-hexahydro-naphthalen-1-yl)-3-methoxy-propan-1-one (CHEBI:212473) is a* tertiary alcohol (CHEBI:26878)

IUPAC Name
1-[(1R,2R,6S,8S,8aS)-2,8-dihydroxy-1,2,6-trimethyl-6,7,8,8a-tetrahydronaphthalen-1-yl]-3-methoxypropan-1-one

Manual Xrefs	Databases
26949188	ChemSpider