Guanosine-3'-monophosphate

Details

• Internal ID: 27fc0343-a7b0-45b1-a38c-031db0e33a73
• Taxonomy: Nucleosides, nucleotides, and analogues > Ribonucleoside 3-phosphates
• IUPAC Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
• SMILES (Canonical): C1=NC2=C(N1C3C(C(C(O3)CO)OP(=O)(O)O)O)N=C(NC2=O)N
• SMILES (Isomeric): C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)OP(=O)(O)O)O)N=C(NC2=O)N
• InChI: InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-5(17)6(3(1-16)22-9)23-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1
• InChI Key: ZDPUTNZENXVHJC-UUOKFMHZSA-N
• Popularity: 30 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₀H₁₄N₅O₈P
• Molecular Weight: 363.22 g/mol
• Exact Mass: 363.05799942 g/mol
• Topological Polar Surface Area (TPSA): 202.00 Ų
• XlogP: -3.50

Synonyms

• Guanosine 3'-monophosphate
• 117-68-0
• GUANOSINE-3'-MONOPHOSPHATE
• 3'-GMP
• guanosine 3'-phosphate
• Guanosine 3'-(dihydrogen phosphate)
• Guo-3'-P
• 839SG0O89X
• guanosine 3/'-(dihydrogen phosphate)
• [(2R,3S,4R,5R)-5-(2-amino-6-hydroxypurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
• 3GP
• UNII-839SG0O89X
• EINECS 204-202-1
• GuanylsA currencyure
• SCHEMBL94114
• GUANYLIC ACID [WHO-DD]
• 3'-GUANYLIC ACID [MI]
• CHEBI:28072
• DTXSID70904627
• ZDPUTNZENXVHJC-UUOKFMHZSA-N
• DB03315
• C06193
• Q27103490
• 6H-Purin-6-one, 2-amino-1,9-dihydro-9-(3-O-phosphono-beta-D-ribofuranosyl)-
• [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
• [(2R,3S,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate

2D Structure

ADMET Properties (via admetSAR 2)

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

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	97.71%	96.09%
CHEMBL4040	P28482	MAP kinase ERK2	94.67%	83.82%
CHEMBL2635	P51452	Dual specificity protein phosphatase 3	92.50%	94.00%
CHEMBL3038477	P67870	Casein kinase II alpha/beta	91.90%	99.23%
CHEMBL1075162	Q13304	Uracil nucleotide/cysteinyl leukotriene receptor	91.83%	80.33%
CHEMBL4203	Q9HAZ1	Dual specificity protein kinase CLK4	91.23%	94.45%
CHEMBL226	P30542	Adenosine A1 receptor	89.04%	95.93%
CHEMBL3137262	O60341	LSD1/CoREST complex	88.32%	97.09%
CHEMBL3401	O75469	Pregnane X receptor	87.58%	94.73%
CHEMBL4016	P42262	Glutamate receptor ionotropic, AMPA 2	86.71%	86.92%
CHEMBL4523377	Q86WV6	Stimulator of interferon genes protein	84.63%	95.48%
CHEMBL3230	O95977	Sphingosine 1-phosphate receptor Edg-6	83.82%	94.01%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	82.93%	95.56%
CHEMBL2107	P61073	C-X-C chemokine receptor type 4	81.31%	93.10%
CHEMBL5608	Q16288	NT-3 growth factor receptor	81.25%	95.89%
CHEMBL1806	P11388	DNA topoisomerase II alpha	80.54%	89.00%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	80.31%	91.11%
CHEMBL3060	Q9Y345	Glycine transporter 2	80.15%	99.17%

Plants that contains it

• Helianthus tuberosus

Cross-Links

• PubChem: 135398727
• LOTUS: LTS0262344
• wikiData: Q27103490