Tìm theo
Cardiolipin
Các tên gọi khác (3) :
  • CDL
  • Diphosphatidyl Glycerol
  • Diphosphatidylglycerol
Thuốc Gốc
Small Molecule
CTHH: C81H158O17P2
PTK: 1466.0585
Cardiolipin (bisphosphatidyl glycerol) is an important component of the inner mitochondrial membrane, where it constitutes about 20% of the total lipid. It is typically present in metabolically active cells of the heart and skeletal muscle, in the membranes of their mitochondria, mostly in the inner membrane, and consists roughly 20% of its lipids. It has also been observed in certain bacterial membranes. It serves as an insulator and stabilizes the activity of protein complexes important to the electron transport chain. It also "glues" them together. Cardiolipin is a "double" phospholipid because it has four fatty acid tails, instead of the usual two. [Wikipedia]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C81H158O17P2
Phân tử khối
1466.0585
Monoisotopic mass
1465.097426654
InChI
InChI=1S/C81H158O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-78(83)91-71-76(97-80(85)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-95-99(87,88)93-69-75(82)70-94-100(89,90)96-74-77(98-81(86)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4)72-92-79(84)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2/h75-77,82H,5-74H2,1-4H3,(H,87,88)(H,89,90)/t76-,77-/m1/s1
InChI Key
InChIKey=XVTUQDWPJJBEHJ-KZCWQMDCSA-N
IUPAC Name
[(2R)-2,3-bis(octadecanoyloxy)propoxy][3-({[(2R)-2,3-bis(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy]phosphinic acid
Traditional IUPAC Name
(2R)-2,3-bis(octadecanoyloxy)propoxy(3-{[(2R)-2,3-bis(octadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy)phosphinic acid
SMILES
CCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO[P@@](O)(=O)OCC(O)CO[P@](O)(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
Độ hòa tan
6.62e-05 g/l
logP
27.27
logS
-7.3
pKa (strongest acidic)
1.59
pKa (Strongest Basic)
-3.4
PSA
236.95 Å2
Refractivity
406.91 m3·mol-1
Polarizability
184.51 Å3
Rotatable Bond Count
86
H Bond Acceptor Count
9
H Bond Donor Count
3
Physiological Charge
-2
Number of Rings
0
Bioavailability
0
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB03429
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=449005
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46507093
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C05980
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