Tìm theo
Guanosine-5'-Monophosphate
Thuốc Gốc
Small Molecule
CAS: 85-32-5
CTHH: C10H14N5O8P
PTK: 363.2206
Guanosine 5'-monophosphate. A guanine nucleotide containing one phosphate group esterified to the sugar moiety and found widely in nature. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C10H14N5O8P
Phân tử khối
363.2206
Monoisotopic mass
363.057998961
InChI
InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6+,9+/m0/s1
InChI Key
InChIKey=RQFCJASXJCIDSX-BZKDHIKHSA-N
IUPAC Name
{[(2S,3R,4R,5R)-5-(2-amino-6-oxo-6,9-dihydro-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
Traditional IUPAC Name
[(2S,3R,4R,5R)-5-(2-amino-6-oxo-1H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxyphosphonic acid
SMILES
NC1=NC2=C(N=CN2[C@@H]2O[C@@H](COP(O)(O)=O)[C@H](O)[C@H]2O)C(=O)N1
Độ hòa tan
3.56e+00 g/l
logP
-2.9
logS
-2
pKa (strongest acidic)
1.05
pKa (Strongest Basic)
1.73
PSA
201.75 Å2
Refractivity
75.49 m3·mol-1
Polarizability
30.65 Å3
Rotatable Bond Count
4
H Bond Acceptor Count
10
H Bond Donor Count
6
Physiological Charge
-2
Number of Rings
3
Bioavailability
0
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB01972
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=5748251
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46504973
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C00144
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