Molecule ID: 122391322

IUPAC Name: (2S)-2-amino-5-[hydroxy-[(E)-5-hydroxy-3-methylpent-2-enoyl]amino]pentanoic acid

Description: The molecule is an L-ornithine derivative obtained by formal condensation of the carboxy group of anhydromevalonic acid with the hydroxylamine nitrogen of N(5)-hydroxy-L-ornithine. It is a homoallylic alcohol, a L-ornithine derivative, a non-proteinogenic alpha-amino acid and a hydroxamic acid.

SMILES: C/C(=C\C(=O)N(O)CCC[C@H](N)C(=O)O)CCO

SELFIES: [C][/C][=Branch2][Ring1][=Branch1][=C][\C][=Branch1][C][=O][N][Branch1][C][O][C][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][O][C][C][O]

InChI: InChI=1S/C11H20N2O5/c1-8(4-6-14)7-10(15)13(18)5-2-3-9(12)11(16)17/h7,9,14,18H,2-6,12H2,1H3,(H,16,17)/b8-7+/t9-/m0/s1

Molecular Properties:
- Polar Surface Area: 124.0 Ų
- LogP: -3.0