Molecule ID: 90659193

IUPAC Name: (2S)-2-(dihydroxyamino)-8-methylsulfanyloctanoate

Description: The molecule is an N,N-dihydroxy-L-polyhomomethioninate that is the conjugate base of N,N-dihydroxy-L-tetrahomomethionine, obtained by deprotonation of the carboxy group; major species at pH 7.3. It is a N,N-dihydroxy-L-polyhomomethioninate and a N,N-dihydroxytetrahomomethioninate. It is a conjugate base of a N,N-dihydroxy-L-tetrahomomethionine.

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

SELFIES: [C][S][C][C][C][C][C][C][C@@H1][Branch1][=Branch1][C][=Branch1][C][=O][O-1][N][Branch1][C][O][O]

InChI: InChI=1S/C9H19NO4S/c1-15-7-5-3-2-4-6-8(9(11)12)10(13)14/h8,13-14H,2-7H2,1H3,(H,11,12)/p-1/t8-/m0/s1

Molecular Properties:
- Polar Surface Area: 109.0 Ų
- LogP: -0.1