input word = C00048144

Metabolite InformationStructural formula
Name Spionoside B
Formula C19H30O9
Mw 402.18898256
CAS RN 438045-54-6
C_ID C00048144 ,
InChIKey AQDQRSAVDNFBEA-IQIYPSBDNA-N
InChICode InChI=1S/C19H30O9/c1-10(27-16-15(24)14(23)13(22)12(8-20)28-16)4-5-19(25)17(2)6-11(21)7-18(19,3)26-9-17/h4-5,10,12-16,20,22-25H,6-9H2,1-3H3/b5-4+/t10-,12+,13+,14-,15+,16+,17+,18+,19-/m0/s1
SMILES O1[C@H]([C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O)O[C@H](/C=C/[C@@]1([C@]2(CO[C@@]1(CC(=O)C2)C)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCapparaceaeCapparis flavicans Ref.
PlantaeCapparaceaeCapparis spinosa Ref.
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