Molecule ID: 21359

IUPAC Name: (2R)-2-amino-3-(3-methylbut-2-enylsulfanyl)propanoic acid

Description: The molecule is a prenylcysteine where the prenyl moiety is attached to the side-chain sulfur atom of L-cysteine. It is a prenylcysteine, a L-cysteine thioether and a S-hydrocarbyl-L-cysteine. It is a tautomer of a S-prenyl-L-cysteine zwitterion.

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

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

InChI: InChI=1S/C8H15NO2S/c1-6(2)3-4-12-5-7(9)8(10)11/h3,7H,4-5,9H2,1-2H3,(H,10,11)/t7-/m0/s1

Molecular Properties:
- Polar Surface Area: 88.6 Ų
- LogP: -1.2