N'-Pyridoxyl-Lysine-5'-Monophosphate
Thuốc Gốc
Small Molecule
CTHH: C14H24N3O7P
PTK: 377.33
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C14H24N3O7P
Phân tử khối
377.33
Monoisotopic mass
377.135186649
InChI
InChI=1S/C14H24N3O7P/c1-9-13(18)11(10(6-17-9)8-24-25(21,22)23)7-16-5-3-2-4-12(15)14(19)20/h6,12,16,18H,2-5,7-8,15H2,1H3,(H,19,20)(H2,21,22,23)/t12-/m1/s1
InChI Key
InChIKey=FIXMYVJXXYQYGI-GFCCVEGCSA-N
IUPAC Name
(2R)-2-amino-6-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]hexanoic acid
Traditional IUPAC Name
(2R)-2-amino-6-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]hexanoic acid
SMILES
CC1=NC=C(COP(O)(O)=O)C(CNCCCC[C@@H](N)C(O)=O)=C1O
Độ hòa tan
3.59e-01 g/l
logP
-7.2
logS
-3
pKa (strongest acidic)
1.58
pKa (Strongest Basic)
10.66
PSA
175.23 Å2
Refractivity
89.3 m3·mol-1
Polarizability
36.33 Å3
Rotatable Bond Count
11
H Bond Acceptor Count
9
H Bond Donor Count
6
Physiological Charge
-1
Number of Rings
1
Bioavailability
0
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
Bạn thấy hài lòng ?
Bạn chưa hài lòng ?
... loading
... loading