FAIRMD Lipids

Lipid N-stearoyl-D-erythro-sphingosine

Name	N-stearoyl-D-erythro-sphingosine
Molecule	CER180
Used in:	Browse Experiments/Simulations Browse Simulations with Quality
Image
Show on GitHub	Molecules/membrane/CER180 main

Property	Value
iupacName	N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]octadecanamide
molecularFormula	C36H71NO3
molecularWeight	566
inChI	InChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29+/t34-,35+/m0/s1
inChIKey	VODZWWMEJITOND-NXCSZAMKSA-N
smiles	CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](/C=C/CCCCCCCCCCCCC)O
image	https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=5283565&t=l

Database	External ID
ChEBI	CHEBI:72961
lipidmaps	LMSP02010006
metabolights	MTBLC72961
pdb.ligand	18C
pubchem.compound	5283565
slm	SLM:000000555

C18 Cer
Cer(d18:1/18:0)
Ceramide (d18:1/18:0)
N-(octadecanoyl)ceramide
N-(octadecanoyl)sphing-4-enine
N-(stearoyl)ceramide
N-octadecanoylsphing-4-enine
N-stearoylsphing-4-enine
N-stearoylsphingosine

⏵ View JSON

{
    "@context": "https://schema.org/",
    "@type": "MolecularEntity",
    "@id": "https://databank.nmrlipids.fi/lipid/59",
    "http://purl.org/dc/terms/conformsTo": {
        "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
        "@type": "CreativeWork"
    },
    "name": "N-stearoyl-D-erythro-sphingosine",
    "url": "https://databank.nmrlipids.fi/lipid/59",
    "inChI": "InChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29+/t34-,35+/m0/s1",
    "inChIKey": "VODZWWMEJITOND-NXCSZAMKSA-N",
    "iupacName": "N-[(E,2S,3R)-1,3-dihydroxyoctadec-4-en-2-yl]octadecanamide",
    "molecularFormula": "C36H71NO3",
    "smiles": "CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](/C=C/CCCCCCCCCCCCC)O",
    "alternateName": [
        "C18 Cer",
        "Cer(d18:1/18:0)",
        "Ceramide (d18:1/18:0)",
        "N-(octadecanoyl)ceramide",
        "N-(octadecanoyl)sphing-4-enine",
        "N-(stearoyl)ceramide",
        "N-octadecanoylsphing-4-enine",
        "N-stearoylsphing-4-enine",
        "N-stearoylsphingosine"
    ],
    "image": "https://pubchem.ncbi.nlm.nih.gov/image/imgsrv.fcgi?cid=5283565&t=l",
    "sameAs": [
        "https://identifiers.org/ChEBI/CHEBI:72961",
        "https://identifiers.org/lipidmaps/LMSP02010006",
        "https://identifiers.org/metabolights/MTBLC72961",
        "https://identifiers.org/pdb.ligand/18C",
        "https://identifiers.org/pubchem.compound/5283565",
        "https://identifiers.org/slm/SLM:000000555"
    ]
}