Molecule ID: 127838

IUPAC Name: (2S,3R)-2-amino-3-hydroxypent-4-ynoic acid

Description: The molecule is a non-proteinogenic L-alpha-amino acid that is L-propargylglycine which is carrying a hydroxy group at the 3R position. It has a role as an antimetabolite, an antibacterial agent, a bacterial metabolite and a fungal metabolite. It is a terminal acetylenic compound and a non-proteinogenic L-alpha-amino acid. It derives from a L-propargylglycine. It is a tautomer of a L-beta-ethynylserine zwitterion.

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

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

InChI: InChI=1S/C5H7NO3/c1-2-3(7)4(6)5(8)9/h1,3-4,7H,6H2,(H,8,9)/t3-,4+/m1/s1

Molecular Properties:
- Polar Surface Area: 83.6 Ų
- LogP: -3.9