input word = C00046024

Metabolite InformationStructural formula
Name Hydropiperoside
Formula C39H40O17
Mw 780.22654986
CAS RN 87611-93-6
C_ID C00046024 ,
InChIKey VJVCHSAJVKCENR-DLCNICSKNA-N
InChICode InChI=1S/C39H40O17/c40-19-28-33(47)35(49)36(50)38(53-28)56-39(21-52-31(45)17-8-23-3-12-26(42)13-4-23)37(54-32(46)18-9-24-5-14-27(43)15-6-24)34(48)29(55-39)20-51-30(44)16-7-22-1-10-25(41)11-2-22/h1-18,28-29,33-38,40-43,47-50H,19-21H2/b16-7+,17-8+,18-9+/t28-,29-,33+,34-,35+,36-,37+,38-,39+/m1/s1
SMILES c1c(ccc(c1)/C=C/C(=O)OC[C@H]1O[C@@]([C@H]([C@@H]1O)OC(=O)/C=C/c1ccc(cc1)O)(COC(=O)/C=C/c1ccc(cc1)O)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygonaceaePolygonum lapathifolium Ref.
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