O-(S-hexanoylpantetheine-4'-phosphoryl)-L-serine residue

Properties Image MNX_ID MNXM728620 reference chebi:78459 formula C20H35N3O9PS*2 global charge -1 mol weight   InChIKey   InChI   SMILES [*]N[C@@H](COP(=O)([O-])OCC(C)(C)[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CCCCC)C([*])=O MNX internals InChI (mnx) InChI=1/C22H42N3O9PS/c1-6-7-8-9-19(28)36-13-12-24-18(27)10-11-25-21(30)20(29)22(3,4)15-34-35(31,32)33-14-17(23-5)16(2)26/h17,20,23,29H,6-15H2,1-5H3,(H,24,27)(H,25,30)(H,31,32)/t17-,20-/m0/s1/i2+1,5+1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][CH2:8][CH2:9][C:19](=[O:28])[S:36][CH2:13][CH2:12][N:24]=[C:18]([CH2:10][CH2:11][N:25]=[C:21]([C@@H:20]([C:22]([CH3:3])([CH3:4])[CH2:15][O:34][P:35]([OH:31])(=[O:32])[O:33][CH2:14][C@@H:17]([C:16]([13CH3:2])=[O:26])[NH:23][13CH3:5])[OH:29])[OH:30])[OH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 9 in models (compartimentalized) 0