FAIRMD Lipids

Lipid 1,2-dioleoyl-sn-glycero-3-phosphocholine

Name	1,2-dioleoyl-sn-glycero-3-phosphocholine
Molecule	DOPC
Used in:	Browse Experiments/Simulations Browse Simulations with Quality
Image
Show on GitHub	Molecules/membrane/DOPC main

Property	Value
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l
iupacName	[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC
inChI	InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1
inChIKey	SNKAWJBJQDLSFF-NVKMUCNASA-N
molecularFormula	C44H84NO8P
molecularWeight	786.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l

Database	External ID
ChEBI	CHEBI:74669
lipidmaps	LMGP01010890
metabolights	MTBLC74669
pubchem.compound	10350317
slm	SLM:000000798

(R-(Z,Z))-(7-Oleoyl-4-oxido-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-enyl)trimethylammonium 4-oxide
1-(9Z)-octadecenoyl-2-(9Z)-octadecenoyl-sn-glycero-3-phosphocholine
1-C18:1(ω-9)-2-C18:1(ω-9)-phosphatidylcholine
1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine
1,2-dioleoyl-L-α-lecithin
Dioleoyl lecithin
Dioleoyl phosphatidylcholine
PC 18:1
PC(18:1(9Z)/18:1(9Z))
PC(18:1/18:1)
phosphatidylcholine 18:1

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/24",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "1,2-dioleoyl-sn-glycero-3-phosphocholine",
    "url": "https://databank.nmrlipids.fi/lipid/24",
    "inChI": "InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,42H,6-19,24-41H2,1-5H3/b22-20-,23-21-/t42-/m1/s1",
    "inChIKey": "SNKAWJBJQDLSFF-NVKMUCNASA-N",
    "iupacName": "[(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate",
    "molecularFormula": "C44H84NO8P",
    "smiles": "CCCCCCCC/C=C\\\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\\\CCCCCCCC",
    "alternateName": [
        "(R-(Z,Z))-(7-Oleoyl-4-oxido-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-enyl)trimethylammonium 4-oxide",
        "1-(9Z)-octadecenoyl-2-(9Z)-octadecenoyl-sn-glycero-3-phosphocholine",
        "1-C18:1(\u03c9-9)-2-C18:1(\u03c9-9)-phosphatidylcholine",
        "1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phosphocholine",
        "1,2-dioleoyl-L-\u03b1-lecithin",
        "Dioleoyl lecithin",
        "Dioleoyl phosphatidylcholine",
        "PC 18:1",
        "PC(18:1(9Z)/18:1(9Z))",
        "PC(18:1/18:1)",
        "phosphatidylcholine 18:1"
    ],
    "image": "https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=10350317&t=l",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:74669",
        "https://identifiers.org/lipidmaps/LMGP01010890",
        "https://identifiers.org/metabolights/MTBLC74669",
        "https://identifiers.org/pubchem.compound/10350317",
        "https://identifiers.org/slm/SLM:000000798"
    ]
}