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03. Biological Effects of Specific Chemicals   
03. Biological Effects of Specific Chemicals 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 06. Name of Biological Source of Chemical   
06. Name of Biological Source of Chemical 
 
 
 
 
 
 
 
  Medicago truncatula (1) 07. Part of Biological Source of Chemical   
07. Part of Biological Source of Chemical 
 
 
 
 
  root [PO:0009005] (486) 08. Chemical Category   
08. Chemical Category 
 
 
 
 
 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
  soyasaponin I [CHEBI:9211] (1) 
 
 
 
 
  soyasaponin I [CHEBI:9211] (1) ChEBI Compound Accession Identifier :  [CHEBI:9211] 
ChEBI Compound Description :  A triterpenoid saponin that is composed of soyasapogenol B having an alpha-L-rhamnopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosiduronic acid moiety attached at the 3-position via a glycosidic linkage. 
ChEBI Compound Identification Number :  9211 
ChEBI InChI Value :  InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)/t21-,23-,24+,25+,26+,27+,28-,29-,30-,31+,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1 
ChEBI InChIKey Value :  PTDAHAWQAGSZDD-IOVCITQVSA-N 
ChEBI Compound Name :  soyasaponin I 
ChEBI SMILES Value :  [H][C@@]12CC(C)(C)C[C@@H](O)[C@]1(C)CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)C(O)=O)[C@](C)(CO)[C@]3([H])CC[C@@]12C 
ChEBI Substance ID :  126522672 
ChEBI URL :  ChEBI:9211  
ChemSpider ID :  NS 
Ontomatica Chemical Accession Key (OnChAKey) :  PTDAHAWQAGSZDD_IOVCITQVSA_N_000_000000 
PubChem Compound ID :  122097