1,2-Dipentadecylmethylidenephosphatidylcholine
Basic information
- CAS
56078-22-9- Standard SMILES
CCCCCCCCCCCCCCCC1(CCCCCCCCCCCCCCC)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O1- InChIKey
DEHLHEOSWIMUGA-UHFFFAOYSA-N- Molecular formula
- C39H80NO6P
- Average molar mass
- 690 g/mol
- Monoisotopic mass
- 689.57232627
Names & identifiers
- Preferred name
- 1,2-Dipentadecylmethylidenephosphatidylcholine
- IUPAC
- [2,2-di(pentadecyl)-1,3-dioxolan-4-yl]methyl 2-(trimethylazaniumyl)ethyl phosphate
- English name
- 1,2-dipentadecylmethylidenephosphatidylcholine
- Molecular formula
- C39H80NO6P
- Molecular weight
- 690.029361
Names & synonyms
1,2-Dipentadecylmethylidenephosphatidylcholine56078-22-9Ethanaminium, 2-((((2,2-dipentadecyl-1,3-dioxolan-4-yl)methoxy)hydroxyphosphinyl)oxy)-N,N,N-trimethyl-, (11beta,16alpha)-RefChem:72020DPMPCSCHEMBL31117513DTXSID00971463(2,2-Dipentadecyl-1,3-dioxolan-4-yl)methyl 2-(trimethylazaniumyl)ethyl phosphate
Database identifiers
- CAS
56078-22-9- PubChem CID
- 189153
- DTXSID
DTXSID00971463
Properties
Computed structural properties
- XLogP
- 14
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 35
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 707
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Related reactions
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Compound notes
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