Molecule ID: 70678631

IUPAC Name: (2S)-2-amino-4-(3-aminopropylamino)butanoic acid

Description: The molecule is the non-proteinogenic L-alpha-amino acid that is norspermidine (1,5,9-triazanonane) carboxylated with S-configuration at the 2-position. It is a conjugate base of a carboxynorspermidine(2+). It derives from a hydride of a bis(3-aminopropyl)amine.

SMILES: NCCCNCC[C@H](N)C(=O)O

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

InChI: InChI=1S/C7H17N3O2/c8-3-1-4-10-5-2-6(9)7(11)12/h6,10H,1-5,8-9H2,(H,11,12)/t6-/m0/s1

Molecular Properties:
- Polar Surface Area: 101.0 Ų
- LogP: -4.7