compound 0235373

Properties Image MNX_ID MNXM1171440 reference envipathM:...57eb50963f5a formula C13H14NO4S global charge -1 mol weight 280.325 InChIKey SVEAUMHIMXKYIE-SREVYHEPSA-M InChI InChI=1S/C13H15NO4S/c15-11-8-9(6-7-12(16)17)13(18)14(11)19-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,16,17)/p-1/b7-6- SMILES O=C([O-])/C=C\C1=CC(=O)N(SC2CCCCC2)C1=O MNX internals InChI (mnx) InChI=1/C13H15NO4S/c15-11-8-9(6-7-12(16)17)13(18)14(11)19-10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,16,17)/b7-6- SMILES (mnx) [CH2:1]1[CH2:2][CH2:4][CH:10]([S:19][N:14]2[C:11](=[O:15])[CH:8]=[C:9](/[CH:6]=[CH:7]\[C:12](=[O:16])[OH:17])[C:13]2=[O:18])[CH2:5][CH2:3]1

Parent-child relations graph

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