input word = C00042873

Metabolite InformationStructural formula
Name Pubescenoside B
(-)-Pubescenoside B
Formula C20H26O11
Mw 442.14751167
CAS RN 850878-25-0
C_ID C00042873 ,
InChIKey NGOIXUCFVRGSAM-LEEKFOJBNA-N
InChICode InChI=1S/C20H26O11/c1-10(7-21)15(9-29-20-19(28)18(27)17(26)14(8-22)31-20)30-16(25)5-3-11-2-4-12(23)13(24)6-11/h2-6,14-15,17-24,26-28H,1,7-9H2/b5-3+/t14-,15-,17-,18+,19-,20-/m1/s1
SMILES C=C(CO)C(CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAquifoliaceaeIlex pubescens Ref.
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