Basic information
- CAS
65492-82-2- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OCC[N+](C)(C)C)OC- InChIKey
MHFRGQHAERHWKZ-UHFFFAOYSA-O- Molecular formula
- C27H59NO6P+
- Average molar mass
- 524.7 g/mol
- Monoisotopic mass
- 524.4080006
Overview
structure given in first source
Names & identifiers
- Preferred name
- Sdz-62-826
- IUPAC
- 2-[hydroxy-(2-methoxy-3-octadecoxypropoxy)phosphoryl]oxyethyl-trimethylazanium
Names & synonyms
SDZ-62-826RefChem:931537SDZ 62-826144615-60-13-Octadecyloxy-2-methoxypropylphosphonocholine2-[hydroxy-(2-methoxy-3-octadecoxypropoxy)phosphoryl]oxyethyl-trimethylazanium130157-42-565492-82-22-((Hydroxy(2-methoxy-3-(octadecyloxy)propoxy)phosphoryl)oxy)-N,N,N-trimethylethanaminium1-Octadecyl-2-methylphosphorylcholineCholine, 1-octadecyl-2-methoxy-3-phosphoryl-PHOSPHORYLCHOLINE, 1-OCTADECYL-2-METHYL- (ALP)
Show more names
2-[hydroxy-(2-methoxy-3-octadecoxy-propoxy)phosphoryl]oxyethyl-trimethyl-ammoniumCHEMBL60166SCHEMBL8251942HSCI1_000364NCI60_0028162-Methoxy-3-(octadecyloxy)propyl 2-(trimethyl-lambda~5~-azanyl)ethyl hydrogen phosphate3,5, 9-Trioxa-4-phosphaheptacosan-1-aminium, 4-hydroxy-7-methoxy-N,N, N-trimethyl-, hydroxide, inner salt, 4-oxide
Database identifiers
- CAS
65492-82-2- PubChem CID
- 1393
- ChEMBL
CHEMBL60166
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 74.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 27
- Heavy atoms
- 35
- Formal charge
- 1
- Complexity
- 501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…