(6R)-10-Formyltetrahydropteroyldiglutamate

Properties Image MNX_ID MNXM33047 reference keggC:C05928 formula C25H30N8O10 global charge 0 mol weight 602.561 InChIKey BHBZPCBOCZGPTF-KBMXLJTQSA-N InChI InChI=1S/C25H30N8O10/c26-25-31-20-19(22(39)32-25)28-13(9-27-20)10-33(11-34)14-3-1-12(2-4-14)21(38)30-16(24(42)43)5-7-17(35)29-15(23(40)41)6-8-18(36)37/h1-4,11,13,15-16,28H,5-10H2,(H,29,35)(H,30,38)(H,36,37)(H,40,41)(H,42,43)(H4,26,27,31,32,39)/t13-,15+,16+/m1/s1 SMILES NC1=NC2=C(N[C@@H](CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)C=C3)CN2)C(=O)N1 MNX internals InChI (mnx) InChI=1/C25H30N8O10/c26-25-31-20-19(22(39)32-25)28-13(9-27-20)10-33(11-34)14-3-1-12(2-4-14)21(38)30-16(24(42)43)5-7-17(35)29-15(23(40)41)6-8-18(36)37/h1-4,11,13,15-16,28H,5-10H2,(H,29,35)(H,30,38)(H,36,37)(H,40,41)(H,42,43)(H4,26,27,31,32,39)/t13-,15+,16+/m1/s1 SMILES (mnx) [CH:1]1=[CH:3][C:14]([N:33]([CH2:10][C@H:13]2[CH2:9][NH:27][C:20]3=[C:19]([C:22]([OH:39])=[N:32][C:25](=[NH:26])[NH:31]3)[NH:28]2)[CH:11]=[O:34])=[CH:4][CH:2]=[C:12]1[C:21]([NH:30][C@@H:16]([CH2:5][CH2:7][C:17](=[N:29][C@@H:15]([CH2:6][CH2:8][C:18](=[O:36])[OH:37])[C:23](=[O:40])[OH:41])[OH:35])[C:24](=[O:42])[OH:43])=[O:38]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 5