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Chemistry

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Also known as: Refchem:1088115, ((2s)-2,3-dihydroxypropyl) 2-(trimethylazaniumyl)ethyl phosphate, 4217-84-9, L-a-glycerylphosphorylcholine(gpc), (s)-?-glycerophosphocholine, Glycerol impurity 6
Molecular Formula
C8H20NO6P
Molecular Weight
257.22  g/mol
InChI Key
SUHOQUVVVLNYQR-QMMMGPOBSA-N

L-Alpha Glycerylphosphorylcholine
Glycerophosphocholine is a metabolite found in or produced by Saccharomyces cerevisiae.
1 2D Structure

L-Alpha Glycerylphosphorylcholine

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(2S)-2,3-dihydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
2.1.2 InChI
InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/t8-/m0/s1
2.1.3 InChI Key
SUHOQUVVVLNYQR-QMMMGPOBSA-N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. Refchem:1088115

2. ((2s)-2,3-dihydroxypropyl) 2-(trimethylazaniumyl)ethyl Phosphate

3. 4217-84-9

4. L-a-glycerylphosphorylcholine(gpc)

5. (s)-?-glycerophosphocholine

6. Glycerol Impurity 6

7. Schembl272506

8. Orb2943113

9. Chembl4750376

10. Dtxsid701354764

11. Hy-w096638a

12. Q60476027

13. (2s)-2,3-dihydroxypropyl 2-(trimethylazaniumyl)ethyl Phosphate

14. (s)-2,3-dihydroxypropyl (2-(trimethylammonio)ethyl) Phosphate

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 257.22 g/mol
Molecular Formula C8H20NO6P
XLogP3-2.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area99.1
Heavy Atom Count16
Formal Charge0
Complexity233
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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