Tìm theo
Glucosamine 6-Phosphate
Thuốc Gốc
Small Molecule
CAS: 3616-42-0
CTHH: C6H14NO8P
PTK: 259.151
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C6H14NO8P
Phân tử khối
259.151
Monoisotopic mass
259.045702941
InChI
InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
InChI Key
InChIKey=XHMJOUIAFHJHBW-VFUOTHLCSA-N
IUPAC Name
{[(2R,3R,4R,5R,6R)-5-amino-3,4,6-trihydroxyoxan-2-yl]methoxy}phosphonic acid
Traditional IUPAC Name
[(2R,3R,4R,5R,6R)-5-amino-3,4,6-trihydroxyoxan-2-yl]methoxyphosphonic acid
SMILES
N[C@H]1[C@H](O)O[C@H](COP(O)(O)=O)[C@H](O)[C@@H]1O
Độ hòa tan
3.48e+01 g/l
logP
-4.2
logS
-0.87
pKa (strongest acidic)
1.22
pKa (Strongest Basic)
8.23
PSA
162.7 Å2
Refractivity
48.45 m3·mol-1
Polarizability
21.53 Å3
Rotatable Bond Count
3
H Bond Acceptor Count
8
H Bond Donor Count
6
Physiological Charge
-1
Number of Rings
1
Bioavailability
1
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02657
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=16019957
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46507552
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C00352
ChemSpider
http://www.chemspider.com/Chemical-Structure.589.html
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