6-(3'-Triphosphoryl-1'-methylglyceryl)-7-methyl-7,8-dihydrobiopterin

Properties Image MNX_ID MNXM10357 reference keggC:C06149 formula C11H20N5O13P3 global charge 0 mol weight 523.225 InChIKey SYGJNAREMBIOCC-UHFFFAOYSA-N InChI InChI=1S/C11H20N5O13P3/c1-4-7(14-6-8(13-4)15-10(12)16-9(6)18)11(2,19)5(17)3-27-31(23,24)29-32(25,26)28-30(20,21)22/h4-5,17,19H,3H2,1-2H3,(H,23,24)(H,25,26)(H2,20,21,22)(H4,12,13,15,16,18) SMILES CC1NC2=C(N=C1C(C)(O)C(O)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(=O)NC(N)=N2 MNX internals InChI (mnx) InChI=1/C11H20N5O13P3/c1-4-7(14-6-8(13-4)15-10(12)16-9(6)18)11(2,19)5(17)3-27-31(23,24)29-32(25,26)28-30(20,21)22/h4-5,17,19H,3H2,1-2H3,(H,23,24)(H,25,26)(H2,20,21,22)(H4,12,13,15,16,18)/t4?,5?,11? SMILES (mnx) [CH3:1][CH:4]1[C:7]([C:11]([CH3:2])([CH:5]([CH2:3][O:27][P:31]([OH:23])(=[O:24])[O:29][P:32]([OH:25])(=[O:26])[O:28][P:30]([OH:20])([OH:21])=[O:22])[OH:17])[OH:19])=[N:14][C:6]2=[C:8]([NH:13]1)[NH:15][C:10](=[NH:12])[N:16]=[C:9]2[OH:18]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0