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

antimycin intermediate 2-[AntC non-ribosomal peptide synthase]

Properties Image MNX_ID MNXM1562927 reference metacycM:Intermediate-2-AntC formula C29H41N5O15PS*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@H](C)OC(=O)[C@@H](NC(=O)c1cccc(NC=O)c1O)[C@@H](C)O)C([*])=O MNX internals InChI (mnx) InChI=1/C31H48N5O15PS/c1-17(38)22(32-6)14-49-52(47,48)50-15-31(4,5)26(42)28(44)34-11-10-23(40)33-12-13-53-30(46)19(3)51-29(45)24(18(2)39)36-27(43)20-8-7-9-21(25(20)41)35-16-37/h7-9,16,18-19,22,24,26,32,39,41-42H,10-15H2,1-6H3,(H,33,40)(H,34,44)(H,35,37)(H,36,43)(H,47,48)/t18-,19+,22+,24+,26+/m1/s1/i1+1,6+1 SMILES (mnx) [13CH3:1][C@@H:16]([C@H:22]([C:27](=[O:43])[O:49][C@H:17]([CH3:2])[C:28](=[O:44])[O:51][CH2:11][CH2:10][CH2:31][C:21]([CH2:8][CH2:9][NH:32][C:26]([C@@H:24]([C:29]([CH3:3])([CH3:4])[CH2:14][O:48][O:50]([OH:45])(=[O:46])[O:47][CH2:13][C@H:18]([C:12](=[NH:35])[PH2:52])[CH2:30][SH:53])[OH:40])=[O:42])=[O:38])[NH:34][C:25]([c:19]1[13cH:6][cH:5][cH:7][c:20]([NH:33][CH:15]=[NH:36])[c:23]1[OH:39])=[O:41])[OH:37]

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-2-AntC metacycM:Intermediate-2-AntC	antimycin intermediate 2-[AntC non-ribosomal peptide synthase]