Metabolomics Structure Database

 
MW REGNO: 58812
Common Name:sn-glycero-3-phosphocholine
Systematic Name:(2R)-2,3-dihydroxypropyl 2-(trimethylammonio)ethyl phosphate
RefMet Name:sn-Glycero-3-phosphocholine
Synonyms:Choline glycerophosphate; Cholini glycerophosphas; Glicerofosfato de colina; Glycerophosphate de choline; Glycerophosphocholine; Glycerophosphorylcholine; L-alpha-Glycerophosphorylcholine; L-alpha-Glycerylphosphorylcholine; sn-Glycero-3-phosphocholine; sn-glycero-3-phosphocholine [PubChem Synonyms]
Exact Mass:
257.1028 (neutral)    Calculate m/z:
Formula:C8H20NO6P
InChIKey:SUHOQUVVVLNYQR-MRVPVSSYSA-N
ClassyFire superclass:Lipids and lipid-like molecules [C0000012]
Massbank MS spectra:View MS spectra
NP-MRD NMR spectra:View NMR spectra
SMILES:C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](CO)O
Studies:Available studies (via RefMet name)

Select appropriate tab below to view additional details:

External database links:

PubChem CID:657272
CHEBI ID:55397
HMDB ID:HMDB0000086
MetaCyc ID:L-1-GLYCERO-PHOSPHORYLCHOLINE
NP-MRD ID(NMR):NP0000619
Plant Metabolite Hub(Pmhub):MS000009702

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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