**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:17]([C@@H:25]([C:30](=[O:47])[O:52][C@H:18]([13CH3:2])[C:22]([C@H:12]([C:24](=[O:42])[O:54][CH2:11][CH2:10][CH2:33][C:23]([CH2:8][CH2:9][CH2:34][C:29]([CH:27]([C:31]([CH3:3])([CH3:4])[CH2:15][O:51][O:53]([OH:48])(=[O:49])[O:50][CH2:14][C@H:19]([C:13](=[NH:37])[OH:55])[CH2:32][PH2:56])[OH:44])=[O:46])=[O:41])[SH:57])=[O:40])[NH:36][C:28]([c:20]1[cH:6][cH:5][13cH:7][c:21]([NH:35][CH:16]=[NH:38])[c:26]1[OH:43])=[O:45])[NH2:39]

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]