2-amino-3-methanesulfinylpropanoic acid

AlkaPlorer ID: AK013194

Synonym: None

IUPAC Name: (2R)-2-amino-3-[(S)-methylsulfinyl]propanoic acid

Structure

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

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InChI: InChI=1S/C4H9NO3S/c1-9(8)2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-,9-/m0/s1

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InChIKey: ZZLHPCSGGOGHFW-KTCWOMIQSA-N

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Properties Information

Molecule Weight: 151.187

TPSA: 80.39

MolLogP: -1.2231999999999987

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT014551 C[S@](=O)C[C@H](N)C(=O)O>>C=C(N)C(=O)O enzymemap_86276
AKRT014552 C[S@](=O)C[C@H](N)C(=O)O>>CC(=O)C(=O)O enzymemap_86047
AKRT014553 C[S@](=O)C[C@H](N)C(=O)O>>CSO enzymemap_86047