(α1S,α4S)-α1,α4-Diamino-1H-imidazole-1,4-dipropanoic acid

CAS Registry Number®

65428-77-5

CAS Name

(α1S,α4S)-α1,α4-Diamino-1H-imidazole-1,4-dipropanoic acid

Molecular Formula

C9H14N4O4

Molecular Mass

242.23

Cite this Page

(α1S,α4S)-α1,α4-Diamino-1H-imidazole-1,4-dipropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=65428-77-5 (retrieved 2024-11-23) (CAS RN: 65428-77-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H14N4O4/c10-6(8(14)15)1-5-2-13(4-12-5)3-7(11)9(16)17/h2,4,6-7H,1,3,10-11H2,(H,14,15)(H,16,17)/t6-,7-/m0/s1

InChIKey

InChIKey=IZQGEZGZCIIKOP-BQBZGAKWSA-N

SMILES

C([C@@H](C(O)=O)N)C1=CN(C[C@@H](C(O)=O)N)C=N1

Canonical SMILES

O=C(O)C(N)CC=1N=CN(C1)CC(N)C(=O)O

Other Names for this Substance

  • 1H-Imidazole-1,4-dipropanoic acid, α1,α4-diamino-, (α1S,α4S)-
  • 1H-Imidazole-1,4-dipropanoic acid, α,α′-diamino-, [S-(R*,R*)]-
  • 1H-Imidazole-1,4-dipropanoic acid, α,α′-diamino-, (αS,α′S)-
  • (α1S,α4S)-α1,α4-Diamino-1H-imidazole-1,4-dipropanoic acid
  • Histidinoalanine