1,2-Di-1-(3,7,11,15-Tetramethyl-Hexadecane)-Sn-Glycero-3-Phosphate
Thuốc Gốc
Small Molecule
CTHH: C43H89O6P
PTK: 733.1369
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C43H89O6P
Phân tử khối
733.1369
Monoisotopic mass
732.639677092
InChI
InChI=1S/C43H89O6P/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-47-33-43(34-49-50(44,45)46)48-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h35-43H,11-34H2,1-10H3,(H2,44,45,46)/t37-,38+,39+,40-,41-,42+,43-/m0/s1
InChI Key
InChIKey=UKQGAMWGTOTQPC-NARORWSISA-N
IUPAC Name
[(2S)-2-{[(3R,7S,11R)-3,7,11,15-tetramethylhexadecyl]oxy}-3-{[(3S,7R,11S)-3,7,11,15-tetramethylhexadecyl]oxy}propoxy]phosphonic acid
Traditional IUPAC Name
(2S)-2-{[(3R,7S,11R)-3,7,11,15-tetramethylhexadecyl]oxy}-3-{[(3S,7R,11S)-3,7,11,15-tetramethylhexadecyl]oxy}propoxyphosphonic acid
SMILES
CC(C)CCC[C@H](C)CCC[C@@H](C)CCC[C@H](C)CCOC[C@@H](COP(O)(O)=O)OCC[C@H](C)CCC[C@@H](C)CCC[C@H](C)CCCC(C)C
Độ hòa tan
5.11e-05 g/l
logP
14.94
logS
-7.2
pKa (strongest acidic)
1.25
pKa (Strongest Basic)
-3.9
PSA
85.22 Å2
Refractivity
215.45 m3·mol-1
Polarizability
94.11 Å3
Rotatable Bond Count
36
H Bond Acceptor Count
5
H Bond Donor Count
2
Physiological Charge
-2
Number of Rings
0
Bioavailability
0
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
Bạn thấy hài lòng ?
Bạn chưa hài lòng ?
... loading
... loading