propanoyl-4'-phosphopantetheine

Properties Image MNX_ID MNXM1129248 reference chebi:172362 formula C14H25N2O8PS global charge -2 mol weight 412.401 InChIKey OJIOOMFWBNFBLF-LBPRGKRZSA-L InChI InChI=1S/C14H27N2O8PS/c1-4-11(18)26-8-7-15-10(17)5-6-16-13(20)12(19)14(2,3)9-24-25(21,22)23/h12,19H,4-9H2,1-3H3,(H,15,17)(H,16,20)(H2,21,22,23)/p-2/t12-/m0/s1 SMILES CCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C14H27N2O8PS/c1-4-11(18)26-8-7-15-10(17)5-6-16-13(20)12(19)14(2,3)9-24-25(21,22)23/h12,19H,4-9H2,1-3H3,(H,15,17)(H,16,20)(H2,21,22,23)/t12-/m0/s1 SMILES (mnx) [CH3:1][CH2:4][C:11](=[O:18])[S:26][CH2:8][CH2:7][N:15]=[C:10]([CH2:5][CH2:6][N:16]=[C:13]([C@@H:12]([C:14]([CH3:2])([CH3:3])[CH2:9][O:24][P:25]([OH:21])([OH:22])=[O:23])[OH:19])[OH:20])[OH:17]

Parent-child relations graph

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