Stearoyl lysophosphatidylcholine
Basic information
- CAS
17364-19-1- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(O)COP(=O)([O-])OCC[N+](C)(C)C- InChIKey
IHNKQIMGVNPMTC-UHFFFAOYSA-N- Molecular formula
- C26H54NO7P
- Average molar mass
- 523.7 g/mol
- Monoisotopic mass
- 523.36379006
Overview
See also: 1-Stearoyl-sn-glycero-3-phosphocholine (annotation moved to).
Names & identifiers
- Preferred name
- Stearoyl lysophosphatidylcholine
- IUPAC
- (2-hydroxy-3-octadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphate
- English name
- 1-Stearoyllysophosphatidylcholine
- Molecular formula
- C26H54NO7P
- Molecular weight
- 523.687
Names & synonyms
17364-19-1RefChem:1099045Stearoyl lysophosphatidylcholine2-Lysophosphatidylcholine5655-17-41-StearoyllysophosphatidylcholineStearoyl alpha-lysolecithin(2-hydroxy-3-octadecanoyloxypropyl) 2-(trimethylazaniumyl)ethyl phosphateStearoyl lysolecithinLPC 18:01-Stearoyl-2-hydroxy-sn-glycero-3-PCEINECS 241-397-2
Show more names
Choline, phosphate, 3-ester with 1-monostearin (7ci)
Choline, hydroxide, dihydrogen phosphate, inner salt, 3-ester with 1-monostearinCholine, phosphate, 3-ester with 1-monostearinSCHEMBL8530885DTXSID80938413IHNKQIMGVNPMTC-UHFFFAOYSA-N(1)-(7-Hydroxy-4-oxido-10-oxo-3,5,9-trioxa-4-phosphaheptacosyl)trimethylammonium 4-oxide3,5,9-Trioxa-4-phosphaheptacosan-1-aminium, 4,7-dihydroxy-N,N,N-trimethyl-10-oxo-, hydroxide,inner salt, 4-oxidePD026710
Database identifiers
- CAS
17364-19-1、5655-17-4- PubChem CID
- 86556
- DTXSID
DTXSID80938413- EC Number
- 241-397-2
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 26
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 546
Chemistry & industry
Additional notes
DefinitionChEBI: A lysophosphatidylcholine 18:0 in which the acyl substituent is located at position 1 and is specified as stearoyl.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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