Search MNXref
 Feedback

N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate

PropertiesImage
MNX_IDMNXM128396 Image of MNXM128396
referencechebi:72951
formulaC18H21N6O8P
global charge-2
mol weight480.374
InChIKeyVNLUYZYZRAWLHI-NGFQHRJXSA-L
InChIInChI=1S/C18H23N6O8P/c19-18-23-16-12(17(27)24-18)22-10(6-21-16)5-20-9-3-1-8(2-4-9)15-14(26)13(25)11(32-15)7-31-33(28,29)30/h1-4,11,13-15,20,25-26H,5-7H2,(H2,28,29,30)(H4,19,21,23,24,27)/p-2/t11-,13-,14-,15+/m1/s1
SMILESNC1=NC2=C(N=C(CNC3=CC=C([C@@H]4O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]4O)C=C3)CN2)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C18H23N6O8P/c19-18-23-16-12(17(27)24-18)22-10(6-21-16)5-20-9-3-1-8(2-4-9)15-14(26)13(25)11(32-15)7-31-33(28,29)30/h1-4,11,13-15,20,25-26H,5-7H2,(H2,28,29,30)(H4,19,21,23,24,27)/t11-,13-,14-,15+/m1/s1 Image of MNXM128396
SMILES (mnx)[CH:1]1=[CH:3][C:9]([NH:20][CH2:5][C:10]2=[N:22][C:12]3=[C:16]([NH:21][CH2:6]2)[NH:23][C:18](=[NH:19])[N:24]=[C:17]3[OH:27])=[CH:4][CH:2]=[C:8]1[C@H:15]1[C@H:14]([OH:26])[C@H:13]([OH:25])[C@@H:11]([CH2:7][O:31][P:33]([OH:28])([OH:29])=[O:30])[O:32]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:72951
chebi:72951
VNLUYZYZRAWLHI-NGFQHRJXSA-L 		N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate
(1S)-1-(4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}phenyl)-1,4-anhydro-5-O-phosphonato-D-ribitol
N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate(2-)

seed.compound:cpd22805
seedM:cpd22805
VNLUYZYZRAWLHI-NGFQHRJXSA-L 		7,8-H2pterin-6-yl-methyl-4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate
7,8-dihydropterin-6-ylmethyl-4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate
N-[(7,8-Dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate

metacyc.compound:CPD-10766
metacycM:CPD-10766
VNLUYZYZRAWLHI-NGFQHRJXSA-L 		7,8-dihydropterin-6-ylmethyl-4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate
7,8-H2pterin-6-yl-methyl-4-(beta-D-ribofuranosyl)aminobenzene 5'-phosphate

kegg.compound:C20562
keggC:C20562
VNLUYZYZRAWLHI-NGFQHRJXSA-N 		N-[(7,8-Dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate

CHEBI:73084
chebi:73084
VNLUYZYZRAWLHI-NGFQHRJXSA-N 		N-[(7,8-dihydropterin-6-yl)methyl]-4-(beta-D-ribofuranosyl)aniline 5'-phosphate
(1S)-1-(4-{[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]amino}phenyl)-1,4-anhydro-5-O-phosphono-D-ribitol

keggC:M_C20562
seedM:M_cpd22805 		secondary/obsolete/fantasy identifier