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03. Biological Effects of Specific Chemicals   
03. Biological Effects of Specific Chemicals 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
  esculeogenin A [CHEBI:71676] (1) 08. Chemical Category   
08. Chemical Category 
 
 
 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) 
 
 
 
 
 
 
 
  esculeogenin A [CHEBI:71676] (1) ChEBI Compound Accession Identifier :  [CHEBI:71676] 
ChEBI Compound Description :  A sapogenin that is spirosolane substituted by hydroxy groups at positions 3, 23 and 27 (the 3beta,5alpha,22alpha,23S,25S stereoisomer). 
ChEBI Compound Identification Number :  71676 
ChEBI InChI Value :  InChI=1S/C27H45NO4/c1-15-24-22(32-27(15)23(31)10-16(14-29)13-28-27)12-21-19-5-4-17-11-18(30)6-8-25(17,2)20(19)7-9-26(21,24)3/h15-24,28-31H,4-14H2,1-3H3/t15-,16-,17-,18-,19+,20-,21-,22-,23-,24-,25-,26-,27-/m0/s1 
ChEBI InChIKey Value :  FBKQAVWTYDQPAB-HBDLFPIVSA-N 
ChEBI Compound Name :  esculeogenin A 
ChEBI SMILES Value :  [H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@@]4(C)[C@@]3([H])C[C@]3([H])O[C@@]5(NC[C@@H](CO)C[C@@H]5O)[C@@H](C)[C@]43[H])[C@@]1(C)CC[C@H](O)C2 
ChEBI Substance ID :  162169189 
ChEBI URL :  ChEBI:71676  
ChemSpider ID :  28639062 
Ontomatica Chemical Accession Key (OnChAKey) :  FBKQAVWTYDQPAB_HBDLFPIVSA_N_000_000000 
PubChem Compound ID :  71306335