Tìm theo
2'-Deoxyuridine
Thuốc Gốc
Small Molecule
CAS: 951-78-0
CTHH: C9H12N2O5
PTK: 228.202
2'-Deoxyuridine. An antimetabolite that is converted to deoxyuridine triphosphate during DNA synthesis. Laboratory suppression of deoxyuridine is used to diagnose megaloblastic anemias due to vitamin B12 and folate deficiencies. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C9H12N2O5
Phân tử khối
228.202
Monoisotopic mass
228.074621504
InChI
InChI=1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8-/m0/s1
InChI Key
InChIKey=MXHRCPNRJAMMIM-BBVRLYRLSA-N
IUPAC Name
1-[(2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Traditional IUPAC Name
2'-deoxyuridine
SMILES
OC[C@H]1O[C@@H](C[C@@H]1O)N1C=CC(=O)NC1=O
Độ tan chảy
163 °C
Độ hòa tan
9.06e+01 g/l
logP
-1.51
logS
-0.4
pKa (strongest acidic)
9.71
pKa (Strongest Basic)
-3
PSA
99.1 Å2
Refractivity
51.05 m3·mol-1
Polarizability
21.16 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
5
H Bond Donor Count
3
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02256
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=1263358
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506680
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C00526
... loading
... loading