Ustusol B (CHEBI:213032)

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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	Ustusol B

ChEBI ID	CHEBI:213032

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O4

Net Charge

Average Mass

268.353

Monoisotopic Mass

268.16746

InChI

InChI=1S/C15H24O4/c1-9-5-11(18)12-13(2,3)6-10(17)7-14(12,4)15(9,19)8-16/h5,10,12,16-17,19H,6-8H2,1-4H3/t10-,12+,14+,15-/m1/s1

InChIKey

MMMVWBXLRFTTSV-UEEZHKSASA-N

SMILES

O=C1C=C([C@](O)(CO)[C@@]2([C@@H]1C(C[C@H](C2)O)(C)C)C)C

Metabolite of Species	Details
Aspergillus (NCBI:txid5052)	See: PubMed

ChEBI Ontology
Outgoing	Ustusol B (CHEBI:213032) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(4R,4aS,6R,8aS)-4,6-dihydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydronaphthalen-1-one