**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

antimycin intermediate 3-[AntD polyketide synthase]

Properties Image MNX_ID MNXM1562928 reference metacycM:Intermediate-3-AntD formula C31H42N5O16PS*3 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@H]([*])C(=O)[C@H](C)OC(=O)[C@@H](NC(=O)c1cccc(NC=O)c1O)[C@@H](C)O)C([*])=O MNX internals InChI (mnx) InChI=1/C34H52N5O16PS/c1-18(27(44)21(4)55-32(49)26(20(3)42)39-30(47)22-9-8-10-23(28(22)45)38-17-40)33(50)57-14-13-36-25(43)11-12-37-31(48)29(46)34(5,6)16-54-56(51,52)53-15-24(35-7)19(2)41/h8-10,17-18,20-21,24,26,29,35,42,45-46H,11-16H2,1-7H3,(H,36,43)(H,37,48)(H,38,40)(H,39,47)(H,51,52)/t18-,20-,21+,24+,26+,29+/m1/s1/i1+1,2+1,7+1 SMILES (mnx) [13CH3:1][C@H:18]([C:27]([C@H:21]([CH3:4])[O:55][C:32]([C@H:26]([C@@H:20]([CH3:3])[OH:42])[NH:39][C:30]([c:22]1[cH:9][cH:8][cH:10][c:23]([NH:38][CH:17]=[O:40])[c:28]1[OH:45])=[O:47])=[O:49])=[O:44])[C:33](=[O:50])[S:57][CH2:14][CH2:13][NH:36][C:25]([CH2:11][CH2:12][NH:37][C:31]([C@@H:29]([C:34]([CH3:5])([CH3:6])[CH2:16][O:54][P:56]([OH:51])(=[O:52])[O:53][CH2:15][C@@H:24]([C:19]([13CH3:2])=[O:41])[NH:35][13CH3:7])[OH:46])=[O:48])=[O:43]

Parent-child relations graph

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

Similar chemical compounds in external resources

Identifier	Description
metacyc.compound:Intermediate-3-AntD metacycM:Intermediate-3-AntD	antimycin intermediate 3-[AntD polyketide synthase]