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

Captopril disulfide

Properties Image MNX_ID MNXM1585622 reference hmdb:HMDB0249600 formula C18H28N2O6S2 global charge 0 mol weight 432.564 InChIKey ZWKRXBCJAUKDCI-UHFFFAOYSA-N InChI InChI=1S/C18H28N2O6S2/c1-11(15(21)19-7-3-5-13(19)17(23)24)9-27-28-10-12(2)16(22)20-8-4-6-14(20)18(25)26/h11-14H,3-10H2,1-2H3,(H,23,24)(H,25,26) SMILES CC(CSSCC(C)C(=O)N1CCCC1C(=O)O)C(=O)N1CCCC1C(=O)O MNX internals InChI (mnx) InChI=1/C18H28N2O6S2/c1-11(15(21)19-7-3-5-13(19)17(23)24)9-27-28-10-12(2)16(22)20-8-4-6-14(20)18(25)26/h11-14H,3-10H2,1-2H3,(H,23,24)(H,25,26)/t11?,12?,13?,14? SMILES (mnx) [CH3:1][CH:11]([CH2:9][S:27][S:28][CH2:10][CH:12]([CH3:2])[C:16]([N:20]1[CH2:8][CH2:4][CH2:6][CH:14]1[C:18](=[O:25])[OH:26])=[O:22])[C:15]([N:19]1[CH2:7][CH2:3][CH2:5][CH:13]1[C:17](=[O:23])[OH:24])=[O:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
hmdb:HMDB0249600 ZWKRXBCJAUKDCI-UHFFFAOYSA-N	Captopril disulfide 1-(3-{[3-(2-carboxypyrrolidin-1-yl)-2-methyl-3-oxopropyl]disulfanyl}-2-methylpropanoyl)pyrrolidine-2-carboxylic acid Captopril disulphide
vmhM:cptprldis vmhM:cptprldis vmhmetabolite:cptprldis vmhmetabolite:cptprldis ZWKRXBCJAUKDCI-UHFFFAOYSA-L	Captopril disulfide
vmhM:M_cptprldis	secondary/obsolete/fantasy identifier