Basic information
- CAS
645-84-1- Standard SMILES
C[N+](C)(C)CCOP(=O)([O-])O- InChIKey
YHHSONZFOIEMCP-UHFFFAOYSA-N- Molecular formula
- C5H14NO4P
- Average molar mass
- 183.14 g/mol
- Monoisotopic mass
- 183.06604493
Overview
Phosphorylcholine is a metabolite found in or produced by Saccharomyces cerevisiae.
Names & identifiers
- Preferred name
- Phosphorylcholine
- IUPAC
- 2-(trimethylazaniumyl)ethyl hydrogen phosphate
- English name
- Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, inner salt
- Molecular formula
- C5H14NO4P
- Molecular weight
- 183.143
Names & synonyms
PHOSPHORYLCHOLINEcholine phosphate2-(trimethylammonio)ethyl hydrogen phosphateBRP7TI555OChloride, Choline PhosphateCholine phosphate chloridePhosphate, CholineCholine Chloride Dihydrogen PhosphateRefChem:929196Chloride, PhosphorylcholinePhosphate Chloride, CholineEthanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, chloride
Show more names
Ethanaminium, N,N,N-trimethyl-2-(phosphonooxy)-, inner salt
645-84-12-(trimethylazaniumyl)ethyl hydrogen phosphateN,N,N-Trimethyl-2-(phosphonooxy)ethanaminium hydroxide inner saltcholinephosphoric acidUNII-BRP7TI555OSCHEMBL8011SCHEMBL4709769CHEMBL3350840
Database identifiers
- CAS
645-84-1- PubChem CID
- 135437
- DTXSID
DTXSID80983064- ChEMBL
CHEMBL3350840- UNII
- BRP7TI555O
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 156
Physicochemical properties
- FDA UNII
- 7 TI555O · BRP7TI555O
Chemistry & industry
Suppliers2 total
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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