**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

Sildenafil metabolite 2

Properties Image MNX_ID MNXM1596321 reference vmhM:sdf_m2 vmhM:sdf_m2 formula C19H27N6O4S global charge 1 mol weight 435.53 InChIKey REQLDLBZEIDOHX-UHFFFAOYSA-O InChI InChI=1S/C19H26N6O4S/c1-4-6-14-16-17(25(3)24-14)19(26)23-18(22-16)13-11-12(7-8-15(13)29-5-2)30(27,28)21-10-9-20/h7-8,11,21H,4-6,9-10,20H2,1-3H3,(H,22,23,26)/p+1 SMILES CCCc1nn(C)c2c(=O)[nH]c(-c3cc(S(=O)(=O)NCC[NH3+])ccc3OCC)nc12 MNX internals InChI (mnx) InChI=1/C19H26N6O4S/c1-4-6-14-16-17(25(3)24-14)19(26)23-18(22-16)13-11-12(7-8-15(13)29-5-2)30(27,28)21-10-9-20/h7-8,11,21H,4-6,9-10,20H2,1-3H3,(H,22,23,26) SMILES (mnx) [CH3:1][CH2:4][CH2:6][c:14]1[c:16]2[c:17]([c:19](=[O:26])[nH:23][c:18](-[c:13]3[cH:11][c:12]([S:30]([NH:21][CH2:10][CH2:9][NH2:20])(=[O:27])=[O:28])[cH:7][cH:8][c:15]3[O:29][CH2:5][CH3:2])[n:22]2)[n:25]([CH3:3])[n:24]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
vmhM:sdf_m2 vmhM:sdf_m2 vmhmetabolite:sdf_m2 vmhmetabolite:sdf_m2 REQLDLBZEIDOHX-UHFFFAOYSA-O	Sildenafil metabolite 2
vmhM:M_sdf_m2	secondary/obsolete/fantasy identifier