input word = C00045460

Metabolite InformationStructural formula
Name Yesanchinoside E
(+)-Yesanchinoside E
Formula C54H92O23
Mw 1108.60293925
CAS RN 416843-87-3
C_ID C00045460 ,
InChIKey BKQLBIWHYYCPJF-GOCAFMFMNA-N
InChICode InChI=1S/C54H92O23/c1-22(2)11-10-14-54(9,77-48-43(69)39(65)36(62)29(75-48)21-70-46-41(67)38(64)34(60)27(19-55)73-46)24-12-16-52(7)32(24)25(57)17-30-51(6)15-13-31(58)50(4,5)45(51)26(18-53(30,52)8)72-49-44(40(66)35(61)28(20-56)74-49)76-47-42(68)37(63)33(59)23(3)71-47/h11,23-49,55-69H,10,12-21H2,1-9H3/t23-,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+,51+,52+,53+,54-/m0/s1
SMILES CC(C)=CCC[C@](C)(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)C[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax japonicus Ref.
PlantaeAraliaceaePanax pseudo-ginseng var.japonicus Ref.
zoom in



OrganismPanax japonicus
ReferenceZou,J.Nat.Prod.,65,(2002),346