an acyl-4'-phosphopantetheine

Properties Image MNX_ID MNXM163267 reference chebi:132023 formula C12H20N2O8PS* global charge -2 mol weight   InChIKey   InChI   SMILES [*]C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])[O-] MNX internals InChI (mnx) InChI=1/C13H25N2O8PS/c1-9(16)25-7-6-14-10(17)4-5-15-12(19)11(18)13(2,3)8-23-24(20,21)22/h11,18H,4-8H2,1-3H3,(H,14,17)(H,15,19)(H2,20,21,22)/t11-/m0/s1/i1+1 SMILES (mnx) [13CH3:1][C:9](=[O:16])[S:25][CH2:7][CH2:6][N:14]=[C:10]([CH2:4][CH2:5][N:15]=[C:12]([C@@H:11]([C:13]([CH3:2])([CH3:3])[CH2:8][O:23][P:24]([OH:20])([OH:21])=[O:22])[OH:18])[OH:19])[OH:17]

Parent-child relations graph

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