Molecule ID: 114835

IUPAC Name: 2-amino-3-methylselanylpropanoic acid

Description: The molecule is an alpha-amino acid compound having methylselanylmethyl as the side-chain. It has a role as an antineoplastic agent and a human metabolite. It is a member of selenocysteines and a non-proteinogenic alpha-amino acid. It is a conjugate base of a Se-methylselenocysteinium. It is a conjugate acid of a Se-methylselenocysteinate.

SMILES: C[Se]CC(N)C(=O)O

SELFIES: [C][Se][C][C][Branch1][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C4H9NO2Se/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)

Molecular Properties:
- Polar Surface Area: 63.3 Ų
- LogP: nan