dTDP-D-galacturonate

Properties Image MNX_ID MNXM3267 reference keggC:C03034 formula C16H24N2O17P2 global charge 0 mol weight 578.313 InChIKey WNUWWHMCMPDGLG-HRSYOOLJSA-N InChI InChI=1S/C16H24N2O17P2/c1-5-3-18(16(26)17-13(5)23)8-2-6(19)7(32-8)4-31-36(27,28)35-37(29,30)34-15-11(22)9(20)10(21)12(33-15)14(24)25/h3,6-12,15,19-22H,2,4H2,1H3,(H,24,25)(H,27,28)(H,29,30)(H,17,23,26)/t6-,7+,8+,9-,10+,11+,12-,15+/m0/s1 SMILES CC1=CN([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)O2)C(=O)NC1=O MNX internals InChI (mnx) InChI=1/C16H24N2O17P2/c1-5-3-18(16(26)17-13(5)23)8-2-6(19)7(32-8)4-31-36(27,28)35-37(29,30)34-15-11(22)9(20)10(21)12(33-15)14(24)25/h3,6-12,15,19-22H,2,4H2,1H3,(H,24,25)(H,27,28)(H,29,30)(H,17,23,26)/t6-,7+,8+,9-,10+,11+,12-,15+/m0/s1 SMILES (mnx) [CH3:1][C:5]1=[CH:3][N:18]([C@H:8]2[CH2:2][C@H:6]([OH:19])[C@@H:7]([CH2:4][O:31][P:36]([OH:27])(=[O:28])[O:35][P:37]([OH:29])(=[O:30])[O:34][C@@H:15]3[C@H:11]([OH:22])[C@@H:9]([OH:20])[C@@H:10]([OH:21])[C@@H:12]([C:14](=[O:24])[OH:25])[O:33]3)[O:32]2)[C:16](=[O:26])[N:17]=[C:13]1[OH:23]

Parent-child relations graph

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