input word = C00037721

Metabolite InformationStructural formula
Name Latifoloside B
(-)-Latifoloside B
Randiasaponin V
(-)-Randiasaponin V
Formula C47H76O17
Mw 912.508251
CAS RN 55965-03-2
C_ID C00037721 ,
InChIKey UJSPEUFZQCLQRS-ZPGYARKXNA-N
InChICode InChI=1S/C47H76O17/c1-21-29(50)32(53)34(55)38(60-21)63-36-30(51)23(49)20-59-40(36)62-27-12-13-44(6)25(43(27,4)5)11-14-46(8)26(44)10-9-22-28-37(57)42(2,3)15-17-47(28,18-16-45(22,46)7)41(58)64-39-35(56)33(54)31(52)24(19-48)61-39/h9,21,23-40,48-57H,10-20H2,1-8H3/t21-,23-,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-,34+,35+,36+,37-,38-,39-,40-,44-,45+,46+,47-/m0/s1
SMILES C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@]4(C)[C@H]5CC=C6[C@@H]7[C@H](O)C(C)(C)CC[C@]7(C(=O)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]6(C)[C@]5(C)CC[C@H]4C3(C)C)OC[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAquifoliaceaeIlex latifolia Ref.
PlantaeRubiaceaeRandia formosa Ref.
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OrganismRandia formosa
ReferenceSahpaz,Phytochem.,54,(2000),77