input word = C00029249

Metabolite InformationStructural formula
Name Yibeinoside C
Formula C39H65NO12
Mw 739.45067655
CAS RN 157536-48-6
C_ID C00029249 ,
InChIKey KULQLSZFAUNSSF-ACOKFBHXNA-N
InChICode InChI=1S/C39H65NO12/c1-18-5-8-26(40-15-18)19(2)22-6-7-23-21-14-27(43)25-13-20(9-11-39(25,4)24(21)10-12-38(22,23)3)49-36-34(48)32(46)35(29(17-42)51-36)52-37-33(47)31(45)30(44)28(16-41)50-37/h18-26,28-37,40-42,44-48H,5-17H2,1-4H3/t18-,19-,20-,21-,22+,23-,24-,25+,26+,28+,29+,30-,31-,32-,33+,34+,35+,36+,37-,38-,39+/m0/s1
SMILES C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2=O)[C@H]2[C@@](CC1)([C@H](CC2)[C@@H]([C@H]1CC[C@@H](CN1)C)C)C)C)O[C@@H]1O[C@@H]([C@H]([C@H]([C@H]1O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeLiliaceaeFritillaria pallidiflora Ref.
zoom in