Chemical Component Summary

NameOCTAHYDROINDOLE-2-CARBOXYLIC ACID
Identifiers(2S,3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxylic acid
FormulaC9 H15 N O2
Molecular Weight169.221
TypeL-PEPTIDE LINKING
Isomeric SMILESC1CC[C@H]2[C@@H](C1)C[C@H](N2)C(=O)O
InChIInChI=1S/C9H15NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h6-8,10H,1-5H2,(H,11,12)/t6-,7-,8-/m0/s1
InChIKeyCQYBNXGHMBNGCG-FXQIFTODSA-N

Chemical Details

Formal Charge0
Atom Count27
Chiral Atom Count3
Bond Count28
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB03409 
NameL-Octahydroindole-2-carboxylic acid
Groups experimental
Synonyms
  • (2S,3aS,7aS)-Octahydroindole-2-carboxylic acid
  • L-Octahydroindole-2-carboxylic acid
  • Perindopril impurity A
  • (2S,3aS,7aS)-2-Carboxyoctahydroindole
CAS number80875-98-5

Related Resource References

Resource NameReference
PubChem 7408452, 7408451