Tìm theo
Trimethyl Glycine
Thuốc Gốc
Small Molecule
CTHH: C5H12NO2
PTK: 118.1543
A naturally occurring compound that has been of interest for its role in osmoregulation. As a drug, betaine hydrochloride has been used as a source of hydrochloric acid in the treatment of hypochlorhydria. Betaine has also been used in the treatment of liver disorders, for hyperkalemia, for homocystinuria, and for gastrointestinal disturbances. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1341)
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C5H12NO2
Phân tử khối
118.1543
Monoisotopic mass
118.086803633
InChI
InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3/p+1
InChI Key
InChIKey=KWIUHFFTVRNATP-UHFFFAOYSA-O
IUPAC Name
(carboxymethyl)trimethylazanium
Traditional IUPAC Name
trimethyl glycine
SMILES
C[N+](C)(C)CC(O)=O
Độ hòa tan
1.75e+00 g/l
logP
-4.5
logS
-1.9
pKa (strongest acidic)
2.26
PSA
37.3 Å2
Refractivity
41.99 m3·mol-1
Polarizability
12.52 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
0
Bioavailability
1
Rule of Five
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB04455
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=248
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506049
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