Molecule ID: 90657204

IUPAC Name: (2S)-2-(dihydroxyamino)-6-methylsulfanylhexanoic acid

Description: The molecule is an N,N-dihydroxy-L-polyhomomethionine in which there are four methylene groups between the alpha-carbon and sulfur atoms. It is a N,N-dihydroxy-L-polyhomomethionine and a N,N-dihydroxydihomomethionine. It is a conjugate acid of a N,N-dihydroxy-L-dihomomethioninate.

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

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

InChI: InChI=1S/C7H15NO4S/c1-13-5-3-2-4-6(7(9)10)8(11)12/h6,11-12H,2-5H2,1H3,(H,9,10)/t6-/m0/s1

Molecular Properties:
- Polar Surface Area: 106.0 Ų
- LogP: -1.6