input word = C00010187

Metabolite InformationStructural formula
Name Maackiain 3-O-galactoside
Formula C22H22O10
Mw 446.12129692
CAS RN 114761-94-3
C_ID C00010187 ,
InChIKey VGSYCWGXBYZLLE-UOKXWHLVNA-N
InChICode InChI=1S/C22H22O10/c23-6-17-18(24)19(25)20(26)22(32-17)30-9-1-2-10-13(3-9)27-7-12-11-4-15-16(29-8-28-15)5-14(11)31-21(10)12/h1-5,12,17-26H,6-8H2/t12-,17-,18+,19+,20-,21-,22-/m1/s1
SMILES O(c1cc2c([C@@H]3[C@H](CO2)c2c(O3)cc3c(c2)OCO3)cc1)[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeTrifolium pratense Ref.
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