input word = C00011170

Metabolite InformationStructural formula
Name Pongamoside D
Formula C23H22O11
Mw 474.11621155
CAS RN 713524-66-4
C_ID C00011170 ,
InChIKey RQSSRCUNGIYPIQ-KULBGAJJNA-N
InChICode InChI=1S/C23H22O11/c1-29-22-17(25)12-4-3-11(32-23-20(28)19(27)18(26)16(8-24)34-23)7-14(12)33-21(22)10-2-5-13-15(6-10)31-9-30-13/h2-7,16,18-20,23-24,26-28H,8-9H2,1H3/t16-,18-,19+,20-,23-/m1/s1
SMILES COc1c(-c2ccc3c(c2)OCO3)oc2cc(O[C@@H]3OC(CO)[C@@H](O)[C@H](O)C3O)ccc2c1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMillettia pinnata Ref.
PlantaeFabaceaePongamia pinnata Ref.
PlantaeSolanaceaeHyoscyamus niger Ref.
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