O-(S-3-oxohexanoylpantetheine-4'-phosphoryl)-L-serine residue

Properties Image MNX_ID MNXM728606 reference chebi:78456 formula C20H33N3O10PS*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)CC(=O)CCC)C([*])=O MNX internals InChI (mnx) InChI=1/C22H40N3O10PS/c1-6-7-16(27)12-19(29)37-11-10-24-18(28)8-9-25-21(31)20(30)22(3,4)14-35-36(32,33)34-13-17(23-5)15(2)26/h17,20,23,30H,6-14H2,1-5H3,(H,24,28)(H,25,31)(H,32,33)/t17-,20-/m0/s1/i2+1,5+1 SMILES (mnx) [CH3:1][CH2:6][CH2:7][C:16]([CH2:12][C:19](=[O:29])[S:37][CH2:11][CH2:10][N:24]=[C:18]([CH2:8][CH2:9][N:25]=[C:21]([C@@H:20]([C:22]([CH3:3])([CH3:4])[CH2:14][O:35][P:36]([OH:32])(=[O:33])[O:34][CH2:13][C@@H:17]([C:15]([13CH3:2])=[O:26])[NH:23][13CH3:5])[OH:30])[OH:31])[OH:28])=[O:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 0