input word = C00047193

Metabolite InformationStructural formula
Name Borivilianoside G
(-)-Borivilianoside G
Formula C51H82O24
Mw 1078.51960355
CAS RN 1112992-35-4
C_ID C00047193 ,
InChIKey MLJWHBNFRZSTSE-YUPCYFMUNA-N
InChICode InChI=1S/C51H82O24/c1-19-7-10-51(66-18-19)20(2)32-27(75-51)12-24-22-6-5-21-11-26(25(56)13-50(21,4)23(22)8-9-49(24,32)3)67-45-41(65)38(62)42(31(17-55)71-45)72-48-44(74-47-40(64)37(61)34(58)29(15-53)69-47)43(35(59)30(16-54)70-48)73-46-39(63)36(60)33(57)28(14-52)68-46/h20-48,52-65H,1,5-18H2,2-4H3/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29+,30+,31+,32-,33-,34+,35+,36-,37-,38+,39+,40+,41+,42-,43-,44+,45+,46-,47-,48-,49-,50-,51+/m0/s1
SMILES C=C1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O[C@@H]6O[C@H](CO)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O)[C@H]7O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnthericaceaeChlorophytum borivilianum Ref.
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OrganismChlorophytum borivilianum
ReferenceAcharya,J.Nat.Prod.,72,(2009),177