Aminopentamide sulfate (USP)

Properties Image MNX_ID MNXM41862 reference keggD:D09703 formula C19H26N2O5S global charge 0 mol weight 394.493 InChIKey GEKOQGPXZRQQHJ-UHFFFAOYSA-N InChI InChI=1S/C19H24N2O.H2O4S/c1-15(21(2)3)14-19(18(20)22,16-10-6-4-7-11-16)17-12-8-5-9-13-17;1-5(2,3)4/h4-13,15H,14H2,1-3H3,(H2,20,22);(H2,1,2,3,4) SMILES CC(CC(C(N)=O)(C1=CC=CC=C1)C1=CC=CC=C1)N(C)C.O=S(=O)(O)O MNX internals InChI (mnx) InChI=1/C19H24N2O.H2O4S/c1-15(21(2)3)14-19(18(20)22,16-10-6-4-7-11-16)17-12-8-5-9-13-17;1-5(2,3)4/h4-13,15H,14H2,1-3H3,(H2,20,22);(H2,1,2,3,4)/t15?; SMILES (mnx) [CH3:1][CH:15]([CH2:14][C:19]([C:16]1=[CH:10][CH:6]=[CH:4][CH:7]=[CH:11]1)([C:17]1=[CH:12][CH:8]=[CH:5][CH:9]=[CH:13]1)[C:18](=[NH:20])[OH:22])[N:21]([CH3:2])[CH3:3].[OH:23][S:27]([OH:24])(=[O:25])=[O:26]

Parent-child relations graph

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