Molecule ID: 25799416

IUPAC Name: (2S)-5-[[amino-(hydroxyamino)methylidene]amino]-2-azaniumylpentanoate

Description: The molecule is zwitterionic form of N(5)-[amino(hydroxyimino)methyl]-L-ornithine having an anionic carboxy group and a protonated alpha-amino group. It is a tautomer of a N(5)-[amino(hydroxyimino)methyl]-L-ornithine.

SMILES: N=C(NO)NCCC[C@H](N)C(=O)O

SELFIES: [N][=C][Branch1][Ring1][N][O][N][C][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C6H14N4O3/c7-4(5(11)12)2-1-3-9-6(8)10-13/h4,13H,1-3,7H2,(H,11,12)(H3,8,9,10)/t4-/m0/s1

Molecular Properties:
- Polar Surface Area: 138.0 Ų
- LogP: -3.6