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8-oxo-dGTP

PropertiesImage
MNX_IDMNXM1363616 Image of MNXM1363616
referencechebi:77896
formulaC10H12N5O14P3
global charge-4
mol weight519.149
InChIKeyBUZOGVVQWCXXDP-VPENINKCSA-J
InChIInChI=1S/C10H16N5O14P3/c11-9-13-7-6(8(17)14-9)12-10(18)15(7)5-1-3(16)4(27-5)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-5,16H,1-2H2,(H,12,18)(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,17)/p-4/t3-,4+,5+/m0/s1
SMILESNC1=NC2=C(NC(=O)N2[C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O2)C(=O)N1
MNX internals
InChI (mnx)InChI=1/C10H16N5O14P3/c11-9-13-7-6(8(17)14-9)12-10(18)15(7)5-1-3(16)4(27-5)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-5,16H,1-2H2,(H,12,18)(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,17)/t3-,4+,5+/m0/s1 Image of MNXM1363616
SMILES (mnx)[CH2:1]1[C@H:3]([OH:16])[C@@H:4]([CH2:2][O:26][P:31]([OH:22])(=[O:23])[O:29][P:32]([OH:24])(=[O:25])[O:28][P:30]([OH:19])([OH:20])=[O:21])[O:27][C@H:5]1[N:15]1[C:7]2=[C:6]([C:8]([OH:17])=[N:14][C:9](=[NH:11])[NH:13]2)[N:12]=[C:10]1[OH:18]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-9731302
reactomeM:R-ALL-9731302
CHEBI:77896
chebi:77896
BUZOGVVQWCXXDP-VPENINKCSA-J 		8-oxo-dGTP
2'-deoxy-8-oxo-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)-7,8-dihydroguanosine
2'-deoxy-8-oxo-7,8-dihydroguanosine 5'-triphosphate
8-oxo-7,8-dihydro-2'-dGTP(4-)
8-oxo-dGTP(4-)
8-oxodeoxyguanosine triphosphate(4-)
hmdb:HMDB0011615
BUZOGVVQWCXXDP-VPENINKCSA-J 		8-Oxo-dGTP
({[(3S)-5-(2-amino-6,8-dioxo-3,7-dihydropurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxyphosphonic acid
({[({[(3S)-5-(2-amino-6,8-dioxo-6,7,8,9-tetrahydro-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid
({[({[(3S)-5-(6,8-dihydroxy-2-imino-3,9-dihydro-2H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonate
2'-Deoxy-7,8-dihydro-8-oxo-guanosine 5'-(tetrahydrogen triphosphate)
8-Hydroxy-2'-deoxyguanosine 5'-triphosphate
8-Hydroxy-dGTP
8-OH-dGTP
8-oxo-2'-Deoxyguanosine 5'-triphosphate
8-oxo-7,8-dihydro-2'-Deoxyguanosine 5'-triphosphate
8-oxo-Deoxyguanosine triphosphate

kegg.compound:C19967
keggC:C19967
BUZOGVVQWCXXDP-VPENINKCSA-N 		8-Oxo-dGTP
8-Oxo-7,8-dihydro-2'-deoxyguanosine 5'-triphosphate
8-Oxodeoxyguanosine triphosphate

metacyc.compound:8-hydroxy-dGTP
metacycM:8-hydroxy-dGTP
BUZOGVVQWCXXDP-VPENINKCSA-J 		8-hydroxy-dGTP
8-hydroxydeoxyguanosine 5'-triphosphate

bigg.metabolite:8oxdgtp
biggM:8oxdgtp
sabiork.compound:25346
sabiorkM:25346
BUZOGVVQWCXXDP-VPENINKCSA-J
BUZOGVVQWCXXDP-VPENINKCSA-N 		8-oxo-dGTP

CHEBI:63222
chebi:63222
BUZOGVVQWCXXDP-VPENINKCSA-K 		8-oxo-dGTP(3-)
2'-deoxy-5'-O-[({[(hydroxyphosphinato)oxy]phosphinato}oxy)phosphinato]-8-oxo-7,8-dihydroguanosine
8-oxo-7,8-dihydro-2'-dGTP(3-)
8-oxo-7,8-dihydro-2'-deoxyguanosine 5'-triphosphate(3-)
8-oxodeoxyguanosine triphosphate(3-)

metacyc.compound:8-Oxo-dGTP
metacycM:8-Oxo-dGTP
BUZOGVVQWCXXDP-VPENINKCSA-J 		8-oxo-dGTP
2'-deoxy-7,8-dihydro-8-oxo-guanosine 5'-triphosphate
7,8-dihydro-8-oxo-2'-dGTP

CHEBI:63220
chebi:63220
BUZOGVVQWCXXDP-VPENINKCSA-N 		8-oxo-dGTP
2'-deoxy-8-oxo-7,8-dihydroguanosine 5'-(tetrahydrogen triphosphate)
8-oxo-7,8-dihydro-2'-dGTP
8-oxo-7,8-dihydro-2'-deoxyguanosine 5'-triphosphate
8-oxodeoxyguanosine triphosphate

hmdb:HMDB11615
biggM:M_8oxdgtp
keggC:M_C19967 		secondary/obsolete/fantasy identifier