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CHEBI:216022 - 5-methoxycochlione B

ChEBI IDCHEBI:216022
ChEBI Name5-methoxycochlione B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O5
Net Charge0
Average Mass240.255
Monoisotopic Mass240.09977
SMILESCO[C@H]1C2=C(OC(C)(C)CC2=O)[C@H]2O[C@H]2[C@@H]1O
InChIInChI=1S/C12H16O5/c1-12(2)4-5(13)6-8(15-3)7(14)10-11(16-10)9(6)17-12/h7-8,10-11,14H,4H2,1-3H3/t7-,8+,10+,11-/m1/s1
InChIKeyVHCLDFUKOVJFAN-YKDSUIRESA-N
Species of MetaboliteComponentSourceComments
Drechsleraspecies (ncbitaxon:67606) - PubMed (29851264)
ChEBI Ontology
Outgoing Relation(s)
5-methoxycochlione B (CHEBI:216022) is a pyranone (CHEBI:37963)
IUPAC Name 
(1aS,2R,3S,7bS)-2-hydroxy-3-methoxy-6,6-dimethyl-2,3,5,7b-tetrahydro-1aH-oxireno[2,3-h]chromen-4-one