sulfonopine

Properties Image MNX_ID MNXM149201 reference metacycM:CPD-15781 formula C9H17NO4S global charge 0 mol weight 235.305 InChIKey HCGHPTKRAXXOSA-MLWJPKLSSA-N InChI InChI=1S/C9H17NO4S/c1-6(8(11)12)10-7(9(13)14)4-5-15(2)3/h6-7,10H,4-5H2,1-3H3,(H-,11,12,13,14)/t6?,7-/m0/s1 SMILES CC([NH2+][C@@H](CC[S+](C)C)C(=O)[O-])C(=O)[O-] MNX internals InChI (mnx) InChI=1/C9H17NO4S/c1-6(8(11)12)10-7(9(13)14)4-5-15(2)3/h6-7,10H,4-5H2,1-3H3,(H-,11,12,13,14)/t6?,7-/m0/s1 SMILES (mnx) [CH3:1][CH:6]([C:8](=[O:11])[OH:12])[NH:10][C@@H:7]([CH2:4][CH2:5][S+:15]([CH3:2])[CH3:3])[C:9](=[O:13])[O-:14]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0