FAIRMD Lipids

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

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

Property	Value
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200
iupacName	[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
inChI	InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1
inChIKey	KILNVBDSWZSGLL-KXQOOQHDSA-N
molecularFormula	C40H80NO8P
molecularWeight	734
image	https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200

Database	External ID
ChEBI	CHEBI:72999
ChEMBL	CHEMBL1200737
lipidmaps	LMGP01010564
metabolights	MTBLC72999
pdb.ligand	PCF
pubchem.compound	452110
slm	SLM:000000505

1-16:0-2-16:0-phosphatidylcholine
1,2-Bis(hexadecanoyl)-sn-glycero-3-phosphocholine
1,2-Dipalmitoyl-L-lecithin
1,2-Dipalmitoyl-sn-glycero-3-phosphatidylcholine
1,2-dipalmitoyl-sn-glycero-3-phosphocholine
1,2-dipalmitoylphosphatidylcholine
16:0-16:0-PC
Dipalmitoyl phosphatidylcholine
dipalmitoyl-GPC
dipalmitoylphosphatidylcholine
GPC(16:0/16:0)
GPCho 16:0/16:0
GPCho(16:0/16:0)
PC 16:0/16:0
PC(16:0/16:0)
PC(32:0)
phosphatidylcholine 16:0/16:0
Phosphatidylcholine(16:0/16:0)
Phosphatidylcholine(32:0)

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/36",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "1,2-dipalmitoyl-sn-glycero-3-phosphocholine",
    "url": "https://databank.nmrlipids.fi/lipid/36",
    "inChI": "InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/t38-/m1/s1",
    "inChIKey": "KILNVBDSWZSGLL-KXQOOQHDSA-N",
    "iupacName": "[(2R)-2,3-di(hexadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate",
    "molecularFormula": "C40H80NO8P",
    "smiles": "CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC",
    "alternateName": [
        "1-16:0-2-16:0-phosphatidylcholine",
        "1,2-Bis(hexadecanoyl)-sn-glycero-3-phosphocholine",
        "1,2-Dipalmitoyl-L-lecithin",
        "1,2-Dipalmitoyl-sn-glycero-3-phosphatidylcholine",
        "1,2-dipalmitoyl-sn-glycero-3-phosphocholine",
        "1,2-dipalmitoylphosphatidylcholine",
        "16:0-16:0-PC",
        "Dipalmitoyl phosphatidylcholine",
        "dipalmitoyl-GPC",
        "dipalmitoylphosphatidylcholine",
        "GPC(16:0/16:0)",
        "GPCho 16:0/16:0",
        "GPCho(16:0/16:0)",
        "PC 16:0/16:0",
        "PC(16:0/16:0)",
        "PC(32:0)",
        "phosphatidylcholine 16:0/16:0",
        "Phosphatidylcholine(16:0/16:0)",
        "Phosphatidylcholine(32:0)"
    ],
    "image": "https://www.ebi.ac.uk/chembl/api/data/image/CHEMBL1200737?dimensions=200",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:72999",
        "https://identifiers.org/ChEMBL/CHEMBL1200737",
        "https://identifiers.org/lipidmaps/LMGP01010564",
        "https://identifiers.org/metabolights/MTBLC72999",
        "https://identifiers.org/pdb.ligand/PCF",
        "https://identifiers.org/pubchem.compound/452110",
        "https://identifiers.org/slm/SLM:000000505"
    ]
}