input word = C00048246

Metabolite InformationStructural formula
Name (6R,9S)-3-Oxo-alpha-ionol beta-D-glucoside
Formula C19H30O7
Mw 370.19915331
CAS RN 142235-25-4
C_ID C00048246 ,
InChIKey SZOPSAFLRCYJCX-QGVBEFKRNA-N
InChICode InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h5-7,11,13-18,20,22-24H,8-9H2,1-4H3/b6-5+/t11-,13-,14+,15-,16-,17+,18+/m0/s1
SMILES O1[C@H]([C@@H]([C@H]([C@H]([C@H]1CO)O)O)O)O[C@H](/C=C/[C@@H]1C(CC(=O)C=C1C)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMacaranga tanarius Ref.
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OrganismMacaranga tanarius
ReferenceKatsuyoshi,Phytochem.,70,(2009),1277