input word = C00005329

Metabolite InformationStructural formula
Name Betuletol 3-galactoside
Formula C23H24O12
Mw 492.12677623
CAS RN 128450-83-9
C_ID C00005329 ,
InChIKey BNHYQVLYKVAVLP-DMADTZQGNA-N
InChICode InChI=1S/C23H24O12/c1-31-10-5-3-9(4-6-10)20-22(35-23-19(30)18(29)15(26)13(8-24)34-23)17(28)14-12(33-20)7-11(25)21(32-2)16(14)27/h3-7,13,15,18-19,23-27,29-30H,8H2,1-2H3/t13-,15+,18-,19-,23+/m1/s1
SMILES COc1ccc(-c2oc3cc(O)c(OC)c(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@H](O)C(O)C2O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium glandulosum Ref.
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