[CorL polyketide synthase] intermediate VIII

Properties Image MNX_ID MNXM1562822 reference metacycM:CorL-Intermediate-VIII formula C31H49N3O9PS*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)/C(C)=C/C=C(\C)CCC/C(C)=C/C/C=C/C)C([*])=O MNX internals InChI (mnx) InChI=1/C33H56N3O9PS/c1-9-10-11-13-24(2)14-12-15-25(3)16-17-26(4)32(41)47-21-20-35-29(38)18-19-36-31(40)30(39)33(6,7)23-45-46(42,43)44-22-28(34-8)27(5)37/h9-10,13,16-17,28,30,34,39H,11-12,14-15,18-23H2,1-8H3,(H,35,38)(H,36,40)(H,42,43)/b10-9+,24-13+,25-16+,26-17+/t28-,30-/m0/s1/i5+1,8+1 SMILES (mnx) [CH3:1]/[CH:9]=[CH:10]/[CH2:11]/[CH:13]=[C:24](\[CH3:2])[CH2:14][CH2:12][CH2:15]/[C:25]([CH3:3])=[CH:16]/[CH:17]=[C:26](\[CH3:4])[C:32](=[O:41])[S:47][CH2:21][CH2:20][N:35]=[C:29]([CH2:18][CH2:19][N:36]=[C:31]([C@@H:30]([C:33]([CH3:6])([CH3:7])[CH2:23][O:45][P:46]([OH:42])(=[O:43])[O:44][CH2:22][C@@H:28]([C:27]([13CH3:5])=[O:37])[NH:34][13CH3:8])[OH:39])[OH:40])[OH:38]

Parent-child relations graph

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