[CorK polyketide synthase] intermediate VI

Properties Image MNX_ID MNXM1562811 reference metacycM:CorK-Intermediate-VI formula C24H36N3O11PS*2 global charge -2 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(/CC/C=C/C)CC(=O)[O-])C([*])=O MNX internals InChI (mnx) InChI=1/C26H44N3O11PS/c1-6-7-8-9-19(14-22(32)33)15-23(34)42-13-12-28-21(31)10-11-29-25(36)24(35)26(3,4)17-40-41(37,38)39-16-20(27-5)18(2)30/h6-7,15,20,24,27,35H,8-14,16-17H2,1-5H3,(H,28,31)(H,29,36)(H,32,33)(H,37,38)/b7-6+,19-15-/t20-,24-/m0/s1/i2+1,5+1 SMILES (mnx) [CH3:1]/[CH:6]=[CH:7]/[CH2:8][CH2:9]/[C:19]([CH2:14][C:22](=[O:32])[OH:33])=[CH:15]/[C:23](=[O:34])[S:42][CH2:13][CH2:12][N:28]=[C:21]([CH2:10][CH2:11][N:29]=[C:25]([C@@H:24]([C:26]([CH3:3])([CH3:4])[CH2:17][O:40][P:41]([OH:37])(=[O:38])[O:39][CH2:16][C@@H:20]([C:18]([13CH3:2])=[O:30])[NH:27][13CH3:5])[OH:35])[OH:36])[OH:31]

Parent-child relations graph

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