FAIRMD Lipids

Lipid 1,2-(14:1$^\Delta9$)-sn-glycero-3-phosphocholine

Name	1,2-(14:1$^\Delta9$)-sn-glycero-3-phosphocholine
Molecule	DRPC
Used in:	Browse Experiments/Simulations Browse Simulations with Quality
Image
Show on GitHub	Molecules/membrane/DRPC main

Property	Value
iupacName	[(2R)-2,3-bis[[(Z)-tetradec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
smiles	CCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCC
inChI	InChI=1S/C36H68NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-35(38)42-32-34(33-44-46(40,41)43-31-30-37(3,4)5)45-36(39)29-27-25-23-21-19-17-15-13-11-9-7-2/h12-15,34H,6-11,16-33H2,1-5H3/b14-12-,15-13-/t34-/m1/s1
inChIKey	AVCZHZMYOZARRJ-JWLMTKEBSA-N
molecularFormula	C36H68NO8P
molecularWeight	673.9
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=24778648&t=l

Database	External ID
ChEBI	CHEBI:137160
lipidmaps	LMGP01010523
pubchem.compound	24778648
slm	SLM:000012476

1,2-di-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/15",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "1,2-(14:1$^\\Delta9$)-sn-glycero-3-phosphocholine",
    "url": "https://databank.nmrlipids.fi/lipid/15",
    "inChI": "InChI=1S/C36H68NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-35(38)42-32-34(33-44-46(40,41)43-31-30-37(3,4)5)45-36(39)29-27-25-23-21-19-17-15-13-11-9-7-2/h12-15,34H,6-11,16-33H2,1-5H3/b14-12-,15-13-/t34-/m1/s1",
    "inChIKey": "AVCZHZMYOZARRJ-JWLMTKEBSA-N",
    "iupacName": "[(2R)-2,3-bis[[(Z)-tetradec-9-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate",
    "molecularFormula": "C36H68NO8P",
    "smiles": "CCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCC",
    "alternateName": [
        "1,2-di-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine"
    ],
    "image": "https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=24778648&t=l",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:137160",
        "https://identifiers.org/lipidmaps/LMGP01010523",
        "https://identifiers.org/pubchem.compound/24778648",
        "https://identifiers.org/slm/SLM:000012476"
    ]
}