MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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dGDP

	Properties	Image
MNX_ID	MNXM436
reference	chebi:58595
formula	C₁₀H₁₂N₅O₁₀P₂
global charge	-3
mol weight	424.179
InChIKey	CIKGWCTVFSRMJU-KVQBGUIXSA-K
InChI	InChI=1S/C10H15N5O10P2/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(24-6)2-23-27(21,22)25-26(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H2,18,19,20)(H3,11,13,14,17)/p-3/t4-,5+,6+/m0/s1
SMILES	NC1=NC2=C(N=CN2[C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])[O-])O2)C(=O)N1

MNX internals

InChI (mnx)	InChI=1/C10H15N5O10P2/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(24-6)2-23-27(21,22)25-26(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1
SMILES (mnx)	[CH2:1]1[C@H:4]([OH:16])[C@@H:5]([CH2:2][O:23][P:27]([OH:21])(=[O:22])[O:25][P:26]([OH:18])([OH:19])=[O:20])[O:24][C@H:6]1[N:15]1[CH:3]=[N:12][C:7]2=[C:8]1[NH:13][C:10](=[NH:11])[N:14]=[C:9]2[OH:17]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	57
in models (compartimentalized)	41

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-110092 reactomeM:R-ALL-110092 reactome:R-ALL-110680 reactomeM:R-ALL-110680 CHEBI:58595 chebi:58595 CIKGWCTVFSRMJU-KVQBGUIXSA-K	dGDP 2'-deoxyguanosine 5'-diphosphate dGDP(3-)
bigg.metabolite:dgdp biggM:dgdp CIKGWCTVFSRMJU-KVQBGUIXSA-K	DGDP
hmdb:HMDB0000960 CIKGWCTVFSRMJU-KVQBGUIXSA-N	dGDP 2'-Deoxy-GDP 2'-Deoxyguanosine 5'-diphosphate 2'-Deoxyguanosine 5'-diphosphoric acid 2'-Deoxyguanosine-5'-diphosphate 5'-dGDP Deoxyguanosine 5'-diphosphate Deoxyguanosine diphosphate Deoxyguanosine diphosphoric acid Deoxyguanosine-diphosphate [({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid
sabiork.compound:1677 sabiorkM:1677 kegg.compound:C00361 keggC:C00361 CIKGWCTVFSRMJU-KVQBGUIXSA-N	dGDP 2'-Deoxyguanosine 5'-diphosphate
CHEBI:28862 chebi:28862 CIKGWCTVFSRMJU-KVQBGUIXSA-N	dGDP 2'-Deoxyguanosine 5'-diphosphate 2'-deoxyguanosine 5'-(trihydrogen diphosphate) 2'-deoxyguanosine 5'-diphosphate deoxyguanosine diphosphate
seed.compound:cpd00295 seedM:cpd00295 CIKGWCTVFSRMJU-KVQBGUIXSA-L	dGDP 2'-Deoxyguanosine 5'-diphosphate 2'-deoxyguanosine-5'-diphosphate deoxyguanosine-diphosphate dgdp
metacyc.compound:DGDP metacycM:DGDP CIKGWCTVFSRMJU-KVQBGUIXSA-K	dGDP 2'-deoxyguanosine-5'-diphosphate deoxyguanosine-diphosphate
vmhM:dgdp vmhmetabolite:dgdp CIKGWCTVFSRMJU-KVQBGUIXSA-K	dGDP [({[(2R,3S,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid
hmdb:HMDB00960 chebi:10495 chebi:19245 chebi:41949 biggM:M_dgdp keggC:M_C00361 seedM:M_cpd00295 vmhM:M_dgdp	secondary/obsolete/fantasy identifier