(3S,3As,9bS)-8-hydroxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2-one (CHEBI:181265)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	(3S,3As,9bS)-8-hydroxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2-one

ChEBI ID	CHEBI:181265

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H18O3

Net Charge

Average Mass

246.306

Monoisotopic Mass

246.12559

InChI

InChI=1S/C15H18O3/c1-7-6-12(16)9(3)13-10(7)4-5-11-8(2)15(17)18-14(11)13/h6,8,11,14,16H,4-5H2,1-3H3/t8-,11-,14-/m0/s1

InChIKey

ZLKGXNSQDUJSAU-PSEJXSGSSA-N

SMILES

O1[C@]2([C@]([C@@H](C1=O)C)(CCC3=C2C(=C(O)C=C3C)C)[H])[H]

ChEBI Ontology
Outgoing	(3S,3As,9bS)-8-hydroxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzofuran-2-one (CHEBI:181265) is a naphthofuran (CHEBI:39270)

IUPAC Name

(3S,3aS,9bS)-8-hydroxy-3,6,9-trimethyl-3a,4,5,9b-tetrahydro-3H-benzo[g][1]benzouran-2-one