FAIRMD Lipids

Lipid Tetramyristoyl cardiolipin

Name	Tetramyristoyl cardiolipin
Molecule	TMCL
Used in:	Browse Experiments/Simulations Browse Simulations with Quality
Image
Show on GitHub	Molecules/membrane/TMCL main

Property	Value
iupacName	[(2R)-3-[[3-[[(2R)-2,3-di(tetradecanoyloxy)propoxy]-hydroxyphosphoryl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxy-2-tetradecanoyloxypropyl] tetradecanoate
smiles	CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC(COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)O)OC(=O)CCCCCCCCCCCCC
inChI	InChI=1S/C65H126O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-62(67)75-55-60(81-64(69)51-47-43-39-35-31-27-23-19-15-11-7-3)57-79-83(71,72)77-53-59(66)54-78-84(73,74)80-58-61(82-65(70)52-48-44-40-36-32-28-24-20-16-12-8-4)56-76-63(68)50-46-42-38-34-30-26-22-18-14-10-6-2/h59-61,66H,5-58H2,1-4H3,(H,71,72)(H,73,74)/t60-,61-/m1/s1
inChIKey	SDCJNZZAOLRVCP-GTOSQJSUSA-N
molecularFormula	C65H126O17P2
molecularWeight	1241.6
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=11159192&t=l

Database	External ID
ChEBI	CHEBI:62862
lipidmaps	LMGP12019AAA
metabolights	MTBLC62862
pdb.ligand	CD4
pubchem.compound	11159192

1,1'2,2'-tetramyristoyl cardiolipin
1,1'2,2'-tetramyristoylcardiolipin
tetramyristoylcardiolipin

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/TMCL",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "Tetramyristoyl cardiolipin",
    "url": "https://databank.nmrlipids.fi/lipid/TMCL",
    "inChI": "InChI=1S/C65H126O17P2/c1-5-9-13-17-21-25-29-33-37-41-45-49-62(67)75-55-60(81-64(69)51-47-43-39-35-31-27-23-19-15-11-7-3)57-79-83(71,72)77-53-59(66)54-78-84(73,74)80-58-61(82-65(70)52-48-44-40-36-32-28-24-20-16-12-8-4)56-76-63(68)50-46-42-38-34-30-26-22-18-14-10-6-2/h59-61,66H,5-58H2,1-4H3,(H,71,72)(H,73,74)/t60-,61-/m1/s1",
    "inChIKey": "SDCJNZZAOLRVCP-GTOSQJSUSA-N",
    "iupacName": "[(2R)-3-[[3-[[(2R)-2,3-di(tetradecanoyloxy)propoxy]-hydroxyphosphoryl]oxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxy-2-tetradecanoyloxypropyl] tetradecanoate",
    "molecularFormula": "C65H126O17P2",
    "smiles": "CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCC(COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC)O)OC(=O)CCCCCCCCCCCCC",
    "alternateName": [
        "1,1'2,2'-tetramyristoyl cardiolipin",
        "1,1'2,2'-tetramyristoylcardiolipin",
        "tetramyristoylcardiolipin"
    ],
    "image": "https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=11159192&t=l",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:62862",
        "https://identifiers.org/lipidmaps/LMGP12019AAA",
        "https://identifiers.org/metabolights/MTBLC62862",
        "https://identifiers.org/pdb.ligand/CD4",
        "https://identifiers.org/pubchem.compound/11159192"
    ]
}