Tìm theo
L-Alfa-Lysophosphatidylcholine, Lauroyl
Thuốc Gốc
Small Molecule
CTHH: C20H43NO7P
PTK: 440.5317
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
440.5317
Monoisotopic mass
440.277714247
InChI
InChI=1S/C20H42NO7P/c1-5-6-7-8-9-10-11-12-13-14-20(23)26-17-19(22)18-28-29(24,25)27-16-15-21(2,3)4/h19,22H,5-18H2,1-4H3/p+1/t19-/m0/s1
InChI Key
InChIKey=BWKILASWCLJPBO-IBGZPJMESA-O
IUPAC Name
[(2S)-3-(dodecanoyloxy)-2-hydroxypropoxy][2-(trimethylazaniumyl)ethoxy]phosphinic acid
Traditional IUPAC Name
(2S)-3-(dodecanoyloxy)-2-hydroxypropoxy(2-(trimethylaminio)ethoxy)phosphinic acid
SMILES
CCCCCCCCCCCC(=O)OC[C@H](O)CO[P@@](O)(=O)OCC[N+](C)(C)C
Độ hòa tan
1.34e-03 g/l
logP
-0.59
logS
-5.5
pKa (strongest acidic)
1.86
pKa (Strongest Basic)
-3.4
PSA
102.29 Å2
Refractivity
124.99 m3·mol-1
Polarizability
50.06 Å3
Rotatable Bond Count
20
H Bond Acceptor Count
4
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
0
Bioavailability
1
Rule of Five
true
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