CL181 – cardiolipin (tetraoctadec-11-enoyl, n-C18:1)

Name
WID CL181 View in model
Name cardiolipin (tetraoctadec-11-enoyl, n-C18:1) View in model
Traditional name 1-({[3-({[2,3-bis(octadec-11-enoyloxy)propyl] phosphonato}oxy)-2-hydroxypropyl] phosphonato}oxy)-3-(octadec-11-enoyloxy)propan-2-yl octadec-11-enoate
IUPAC name 1-({[3-({[2,3-bis(octadec-11-enoyloxy)propyl] phosphonato}oxy)-2-hydroxypropyl] phosphonato}oxy)-3-(octadec-11-enoyloxy)propan-2-yl octadec-11-enoate
Cross references PubChem: 8259, KEGG: C05980, BiGG: clpn181, LIPIDMAPS: LMGP12010000
 
Classification
Type lipid_glycerophospholipid_cardiolipin View in model
 
Structure
Empirical formula (pH 7.5) H148C81O17P2
SMILES (pH 7.5) CCCCCCC=CCCCCCCCCCC(=O)OCC(COP([O-])(=O)OCC(O)COP([O-])(=O)OCC(COC(=O)CCCCCCCCCC=CCCCCCC)OC(=O)CCCCCCCCCC=CCCCCCC)OC(=O)CCCCCCCCCC=CCCCCCC
Charge (pH 7.5) -2
Is hydrophobic True View in model
Molecular weight (Da) 1455.97 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
1514.82
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) 0.0
logP 25.82
logD (pH 7.5) 21.07
 
Concentrations
Biomass composition (SP4 media, 
5% CO2, 37C; mmol gDCW‑1)
  • 0.00215673 [m]

View in model
 
Function
Reaction participant cardiolipin synthase (periplasmic, n-C18:1)
(2) PG181[m] ⇔ CL181[m] + GL[c]
View in model
 
Metadata
Created 2012-10-01 15:06:52
Last updated 2012-10-01 15:11:58