FAIRMD Lipids

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

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

Property	Value
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l
iupacName	[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC
inChI	InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1
inChIKey	NRJAVPSFFCBXDT-HUESYALOSA-N
molecularFormula	C44H88NO8P
molecularWeight	790.1
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l

Database	External ID
ChEBI	CHEBI:83718
lipidmaps	LMGP01010006
metabolights	MTBLC83718
pdb.ligand	PC1
pubchem.compound	94190
slm	SLM:000012489

1,2-Distearoyl-sn-3-phosphacholine
Distearoyl phosphatidylcholine
GPC(18:0/18:0)
GPCho(18:0/18:0)
GPCho(36:0)
PC (18:0)2
PC 18:0/18:0
PC(18:0/18:0)
PC(36:0)
Phosphatidylcholine(18:0/18:0)
Phosphatidylcholine(36:0)

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/4",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "1,2-distearoyl-sn-glycero-3-phosphocholine",
    "url": "https://databank.nmrlipids.fi/lipid/4",
    "inChI": "InChI=1S/C44H88NO8P/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/h42H,6-41H2,1-5H3/t42-/m1/s1",
    "inChIKey": "NRJAVPSFFCBXDT-HUESYALOSA-N",
    "iupacName": "[(2R)-2,3-di(octadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate",
    "molecularFormula": "C44H88NO8P",
    "smiles": "CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCC",
    "alternateName": [
        "1,2-Distearoyl-sn-3-phosphacholine",
        "Distearoyl phosphatidylcholine",
        "GPC(18:0/18:0)",
        "GPCho(18:0/18:0)",
        "GPCho(36:0)",
        "PC (18:0)2",
        "PC 18:0/18:0",
        "PC(18:0/18:0)",
        "PC(36:0)",
        "Phosphatidylcholine(18:0/18:0)",
        "Phosphatidylcholine(36:0)"
    ],
    "image": "https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=94190&t=l",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:83718",
        "https://identifiers.org/lipidmaps/LMGP01010006",
        "https://identifiers.org/metabolights/MTBLC83718",
        "https://identifiers.org/pdb.ligand/PC1",
        "https://identifiers.org/pubchem.compound/94190",
        "https://identifiers.org/slm/SLM:000012489"
    ]
}