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

H Bond Acceptor Count

H Bond Donor Count

Physiological Charge

-2

Number of Rings

Bioavailability

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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