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CHEBI:175834 - Diosbulbin F

ChEBI IDCHEBI:175834
ChEBI NameDiosbulbin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O7
Net Charge0
Average Mass376.405
Monoisotopic Mass376.15220
SMILES[H][C@@]12C[C@@H](O)C[C@@H](C(=O)OC)[C@@]1([H])C(=O)C[C@]1([H])C(=O)O[C@H](c3ccoc3)C[C@@]21C
InChIInChI=1S/C20H24O7/c1-20-8-16(10-3-4-26-9-10)27-19(24)14(20)7-15(22)17-12(18(23)25-2)5-11(21)6-13(17)20/h3-4,9,11-14,16-17,21H,5-8H2,1-2H3/t11-,12+,13+,14+,16-,17+,20-/m0/s1
InChIKeyLPHWMSVPEOJPHG-WEFWDAIHSA-N
ChEBI Ontology
Outgoing Relation(s)
Diosbulbin F (CHEBI:175834) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
methyl (2S,4aS,6aS,7R,9R,10aR,10bS)-2-(uran-3-yl)-9-hydroxy-10b-methyl-4,6-dioxo-1,2,4a,5,6a,7,8,9,10,10a-decahydrobenzo[]isochromene-7-carboxylate
Manual XrefsDatabases
158172ChemSpider
Registry NumbersSources
CAS:66835-37-8ChemIDplus