11,12-epoxy-12beta-hydroxy-1-tremulen-5-one (CHEBI:215619)

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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	11,12-epoxy-12beta-hydroxy-1-tremulen-5-one

ChEBI ID	CHEBI:215619

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H22O3

Net Charge

Average Mass

250.338

Monoisotopic Mass

250.15689

InChI

InChI=1S/C15H22O3/c1-8-10-5-15(2,3)6-11(10)12-7-18-14(17)9(12)4-13(8)16/h8-10,14,17H,4-7H2,1-3H3/t8-,9+,10+,14-/m0/s1

InChIKey

CRJFCBSBKFWULV-KSQLKPTDSA-N

SMILES

O=C1[C@H]([C@@H]2C(CC(C2)(C)C)=C3[C@@H](C1)[C@H](OC3)O)C

Metabolite of Species	Details
Conocybe siliginea (NCBI:txid373326)	See: PubMed

ChEBI Ontology
Outgoing	11,12-epoxy-12beta-hydroxy-1-tremulen-5-one (CHEBI:215619) is a oxolanes (CHEBI:26912)

IUPAC Name

(3S,3aR,6S,6aR)-3-hydroxy-6,8,8-trimethyl-1,3,3a,4,6,6a,7,9-octahydroazuleno[4,5-c]uran-5-one