(6E)-7-(4-hydroxyphenyl)-3,5-dioxohept-6-enoyl-[styrylpyrone synthase]

Properties Image MNX_ID MNXM743729 reference metacycM:12-hydroxy-styryl-pyrone-1-3Ketide formula C27H35N3O12PS*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)CC(=O)CC(=O)/C=C/C1=CC=C(O)C=C1)C([*])=O MNX internals InChI (mnx) InChI=1/C29H42N3O12PS/c1-19(33)24(30-4)17-43-45(41,42)44-18-29(2,3)27(39)28(40)32-12-11-25(37)31-13-14-46-26(38)16-23(36)15-22(35)10-7-20-5-8-21(34)9-6-20/h5-10,24,27,30,34,39H,11-18H2,1-4H3,(H,31,37)(H,32,40)(H,41,42)/b10-7+/t24-,27-/m0/s1/i1+1,4+1 SMILES (mnx) [13CH3:1][C:19]([C@H:24]([CH2:17][O:43][P:45]([OH:41])(=[O:42])[O:44][CH2:18][C:29]([CH3:2])([CH3:3])[C@H:27]([C:28](=[N:32][CH2:12][CH2:11][C:25](=[N:31][CH2:13][CH2:14][S:46][C:26]([CH2:16][C:23]([CH2:15][C:22](/[CH:10]=[CH:7]/[C:20]1=[CH:6][CH:9]=[C:21]([OH:34])[CH:8]=[CH:5]1)=[O:35])=[O:36])=[O:38])[OH:37])[OH:40])[OH:39])[NH:30][13CH3:4])=[O:33]

Parent-child relations graph

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