input word = C00032112

Metabolite InformationStructural formula
Name Pastuchoside C
Pastuchoside C (C36 saponin)
Formula C36H58O8
Mw 618.41316883
CAS RN 29618-15-3
C_ID C00032112 ,
InChIKey OSAXUKOWYDEPJU-UHFFFAOYNA-N
InChICode InChI=1S/C38H62O6/c1-22-18-23(30(41)31(42)29(22)40)19-24-10-12-34(4)27(35(24,5)21-39)11-13-37(7)28(34)9-8-25-26-20-33(2,3)14-16-38(26,32(43)44)17-15-36(25,37)6/h8,22-24,26-31,39-42H,9-21H2,1-7H3,(H,43,44)/t22-,23-,24-,26+,27-,28+,29+,30-,31+,34-,35-,36+,37+,38+/m0/s1
SMILES C1(CC[C@@]2([C@H](C1)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@H]1[C@@]3(CC[C@H]([C@]1(C)CO)C[C@@H]1C[C@@H]([C@H]([C@H]([C@H]1O)O)O)C)C)C)C(=O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaeHedera pastuchowii Ref.
zoom in