CerP(d18:1/18:0)
Basic information
- CAS
128543-23-7- Standard SMILES
CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)O)NC(=O)CCCCCCCCCCCCCCCCC- InChIKey
ZQQLMECVOXKFJK-NXCSZAMKSA-N- Molecular formula
- C36H72NO6P
- Average molar mass
- 645.9 g/mol
- Monoisotopic mass
- 645.50972601
Overview
N-octadecanoylsphingosine 1-phosphate is a ceramide 1-phosphate that is the N-octadecananoyl (stearoyl) derivative of sphingosine. It is functionally related to a sphingosine and an octadecanoic acid. It is a conjugate acid of a N-octadecanoylsphingosine 1-phosphate(2-).
Names & identifiers
- Preferred name
- CerP(d18:1/18:0)
- IUPAC
- [(E,2S,3R)-3-hydroxy-2-(octadecanoylamino)octadec-4-enyl] dihydrogen phosphate
- English name
- CERAMIDE 1-PHOSPHATE
- Molecular formula
- C36H72NO6P
- Molecular weight
- 645.933741
Names & synonyms
CerP(d18:1/18:0)128543-23-7C18 CerPN-(octadecanoyl)-sphing-4-enine-1-phosphate[(E,2S,3R)-3-hydroxy-2-(octadecanoylamino)octadec-4-enyl] dihydrogen phosphateDTXSID90415280((E,2S,3R)-3-hydroxy-2-(octadecanoylamino)octadec-4-enyl) dihydrogen phosphateRefChem:1081367DTXCID80366131ceramide 1-phosphateN-octadecanoylsphingosine 1-phosphate(2S,3R,E)-3-Hydroxy-2-stearamidooctadec-4-en-1-yl dihydrogen phosphate
Show more names
ceramide 1-phosphate from bovine brainCeramide 1-phosphate from bovine brain ~95%
202063-34-1N-octadecanoylsphing-4-enine 1-phosphateLMSP02050004CerP 36:1;O2SCHEMBL29993048CHEBI:73144N-stearoylsphingosine 1-phosphateCerP 18:1;2O/18:0
Database identifiers
- CAS
128543-23-7- PubChem CID
- 5283583
Properties
Computed structural properties
- XLogP
- 12.9
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 34
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 698
Experimental & physicochemical properties
LipidsLipids -> Sphingolipids [SP] -> Ceramides [SP02] -> Ceramide 1-phosphates [SP0205]
Physical DescriptionSolid
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- form
- powder
- color
- White to off-white
- InChIKey
- ZQQLMECVOXKFJK-NXCSZAMKSA-N
- SMILES
- CCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(O)(O)=O)[C@H](O)\C=C\CCCCCCCCCCCCC
- UNSPSC Code
- 12352211 · 12352211
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- Storage Class
- 11 · 11 - Combustible Solids
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Pharmacology
Tissue LocationsAll Tissues
Cellular LocationsExtracellular
Applications
UsesCeramide 1-phosphate is a bioactive lipid and one of the key components of sphingolipids. Ceramide 1-phosphate playing diverse roles in cellular behaviors such as cell differentiation, migration, proliferation and death[1].
Additional notes
DefinitionChEBI: N-octadecanoylsphingosine 1-phosphate is a ceramide 1-phosphate that is the N-octadecananoyl (stearoyl) derivative of sphingosine. It is functionally related to a sphingosine and an octadecanoic acid. It is a conjugate acid of a N-octadecanoylsphingosine 1-phosphate(2-).
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