Guanosine diphos-phate

Details

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Internal ID 4a948257-303c-4681-a912-f1b865793337
Taxonomy Nucleosides, nucleotides, and analogues > Purine nucleotides > Purine ribonucleotides > Purine ribonucleoside diphosphates
IUPAC Name [5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
SMILES (Canonical) C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
SMILES (Isomeric) C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N=C(NC2=O)N
InChI InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)
InChI Key QGWNDRXFNXRZMB-UHFFFAOYSA-N
Popularity 1,259 references in papers

Physical and Chemical Properties

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Molecular Formula C10H15N5O11P2
Molecular Weight 443.20 g/mol
Exact Mass 443.02433031 g/mol
Topological Polar Surface Area (TPSA) 248.00 Ų
XlogP -4.60

Synonyms

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168035-01-6
[5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
SCHEMBL37406
SCHEMBL13210265
BDBM82232
DTXSID00861830
BCP33401
CAS_8977
NSC_8977
FT-0601270
There are more than 10 synonyms. If you wish to see them all click here.

2D Structure

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2D Structure of Guanosine diphos-phate

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
CHEMBL4105784 P51149 Ras-related protein Rab-7a 25.83 nM
Kd
via Super-PRED

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL4040 P28482 MAP kinase ERK2 98.60% 83.82%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 97.68% 96.09%
CHEMBL1075162 Q13304 Uracil nucleotide/cysteinyl leukotriene receptor 97.63% 80.33%
CHEMBL226 P30542 Adenosine A1 receptor 94.98% 95.93%
CHEMBL3038477 P67870 Casein kinase II alpha/beta 93.03% 99.23%
CHEMBL3401 O75469 Pregnane X receptor 91.53% 94.73%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 87.82% 94.00%
CHEMBL3137262 O60341 LSD1/CoREST complex 86.32% 97.09%
CHEMBL5957 P21589 5'-nucleotidase 85.18% 97.78%
CHEMBL2345 P51812 Ribosomal protein S6 kinase alpha 3 84.12% 95.64%
CHEMBL1952 P04818 Thymidylate synthase 83.86% 93.53%
CHEMBL4523377 Q86WV6 Stimulator of interferon genes protein 83.37% 95.48%
CHEMBL2850 P49840 Glycogen synthase kinase-3 alpha 82.90% 88.84%
CHEMBL2094108 P49354 Protein farnesyltransferase 82.39% 97.92%
CHEMBL2107 P61073 C-X-C chemokine receptor type 4 81.26% 93.10%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 80.91% 91.11%
CHEMBL3060 Q9Y345 Glycine transporter 2 80.55% 99.17%
CHEMBL5608 Q16288 NT-3 growth factor receptor 80.49% 95.89%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.38% 86.33%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 80.32% 89.34%
CHEMBL1929 P47989 Xanthine dehydrogenase 80.23% 96.12%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
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There are no matching plants.

Cross-Links

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PubChem 135402030
LOTUS LTS0091599
wikiData Q105220735