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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2005-11-16 15:48:42 UTC

Update Date

2022-09-22 18:35:06 UTC

HMDB ID

HMDB0000114

Secondary Accession Numbers

HMDB00114

Metabolite Identification

Common Name

Glycerylphosphorylethanolamine

Description

Glycerylphosphorylethanolamine, also known as GPEA, belongs to the class of organic compounds known as glycerophosphoethanolamines. These are glycerolipids characterized by an ethanolamine ester of glycerophosphoric acid. As is the case with diacylglycerols, glycerophosphoethanolamines can have many different combinations of fatty acids of varying lengths and saturation attached to the C-1 and C-2 atoms. Glycerylphosphorylethanolamine is a very strong basic compound (based on its pKa).

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

HEADER    PROTEIN                                 06-MAR-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAR-20         0                                  
HETATM    1  O   UNK     0    8652.5708652.910   0.000  0.00  0.00           O+0
HETATM    2  P   UNK     0    8653.9028653.680   0.000  0.00  0.00           P+0
HETATM    3  O   UNK     0    8655.2378652.910   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0    8656.5738653.680   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0    8657.9048652.910   0.000  0.00  0.00           C+0
HETATM    6  N   UNK     0    8659.2408653.680   0.000  0.00  0.00           N+0
HETATM    7  O   UNK     0    8653.1358655.011   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0    8654.6768655.011   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0    8651.2368653.680   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0    8649.9028652.910   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0    8648.5688653.680   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0    8647.2348652.910   0.000  0.00  0.00           O+0
HETATM   13  O   UNK     0    8649.9028651.369   0.000  0.00  0.00           O+0
CONECT    1    2    9                                                       
CONECT    2    1    3    7    8                                             
CONECT    3    2    4                                                       
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    5                                                            
CONECT    7    2                                                            
CONECT    8    2                                                            
CONECT    9    1   10                                                       
CONECT   10    9   11   13                                                  
CONECT   11   10   12                                                       
CONECT   12   11                                                            
CONECT   13   10                                                            
MASTER        0    0    0    0    0    0    0    0   13    0   24    0
END

COMPND    HMDB0000114
HETATM    1  N1  UNL     1      -3.966  -0.211   1.056  1.00  0.00           N  
HETATM    2  C1  UNL     1      -3.625  -0.149  -0.344  1.00  0.00           C  
HETATM    3  C2  UNL     1      -2.157   0.122  -0.564  1.00  0.00           C  
HETATM    4  O1  UNL     1      -1.806   1.336   0.010  1.00  0.00           O  
HETATM    5  P1  UNL     1      -0.184   1.711  -0.192  1.00  0.00           P  
HETATM    6  O2  UNL     1       0.123   2.853   0.783  1.00  0.00           O  
HETATM    7  O3  UNL     1       0.182   2.269  -1.724  1.00  0.00           O  
HETATM    8  O4  UNL     1       0.829   0.441   0.223  1.00  0.00           O  
HETATM    9  C3  UNL     1       1.642   0.133  -0.862  1.00  0.00           C  
HETATM   10  C4  UNL     1       2.573  -1.023  -0.506  1.00  0.00           C  
HETATM   11  O5  UNL     1       1.798  -2.130  -0.171  1.00  0.00           O  
HETATM   12  C5  UNL     1       3.462  -0.652   0.665  1.00  0.00           C  
HETATM   13  O6  UNL     1       2.682  -0.345   1.774  1.00  0.00           O  
HETATM   14  H1  UNL     1      -3.874  -1.194   1.444  1.00  0.00           H  
HETATM   15  H2  UNL     1      -4.990   0.004   1.134  1.00  0.00           H  
HETATM   16  H3  UNL     1      -4.276   0.588  -0.832  1.00  0.00           H  
HETATM   17  H4  UNL     1      -3.839  -1.140  -0.789  1.00  0.00           H  
HETATM   18  H5  UNL     1      -1.934   0.110  -1.648  1.00  0.00           H  
HETATM   19  H6  UNL     1      -1.598  -0.716  -0.078  1.00  0.00           H  
HETATM   20  H7  UNL     1      -0.011   1.613  -2.436  1.00  0.00           H  
HETATM   21  H8  UNL     1       2.205   1.011  -1.219  1.00  0.00           H  
HETATM   22  H9  UNL     1       1.041  -0.220  -1.739  1.00  0.00           H  
HETATM   23  H10 UNL     1       3.199  -1.283  -1.380  1.00  0.00           H  
HETATM   24  H11 UNL     1       1.148  -1.886   0.530  1.00  0.00           H  
HETATM   25  H12 UNL     1       4.171   0.145   0.422  1.00  0.00           H  
HETATM   26  H13 UNL     1       4.047  -1.560   0.926  1.00  0.00           H  
HETATM   27  H14 UNL     1       3.158   0.171   2.454  1.00  0.00           H  
CONECT    1    2   14   15
CONECT    2    3   16   17
CONECT    3    4   18   19
CONECT    4    5
CONECT    5    6    6    7    8
CONECT    7   20
CONECT    8    9
CONECT    9   10   21   22
CONECT   10   11   12   23
CONECT   11   24
CONECT   12   13   25   26
CONECT   13   27
END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Glycerophosphorylethanolamine	ChEBI
sn-Glycerol-3-phosphoethanolamine	ChEBI
Glycerophosphoethanolamine	HMDB
GPEA	HMDB
Glycerol 3-phosphoethanolamine	HMDB
Glycerol 3-phosphorylethanolamine	HMDB
Glycerol phosphorylethanolamine	HMDB
Glyceryl-3-phosphorylethanolamine	HMDB
alpha-Glycerophosphorylethanolamine	HMDB
sn-Glycero-3-phosphoethanolamine	HMDB
Α-glycerophosphorylethanolamine	HMDB
Glycerylphosphorylethanolamine	MeSH

Chemical Formula

C₅H₁₄NO₆P

Average Molecular Weight

215.1415

Monoisotopic Molecular Weight

215.055873697

IUPAC Name

(2-aminoethoxy)(2,3-dihydroxypropoxy)phosphinic acid

Traditional Name

glycerophosphorylethanolamine

CAS Registry Number

1190-00-7

SMILES

NCCOP(O)(=O)OCC(O)CO

InChI Identifier

InChI=1S/C5H14NO6P/c6-1-2-11-13(9,10)12-4-5(8)3-7/h5,7-8H,1-4,6H2,(H,9,10)

InChI Key

JZNWSCPGTDBMEW-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as glycerophosphoethanolamines. These are glycerolipids characterized by an ethanolamine ester of glycerophosphoric acid. As is the case with diacylglycerols, glycerophosphoethanolamines can have many different combinations of fatty acids of varying lengths and saturation attached to the C-1 and C-2 atoms.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Glycerophospholipids

Sub Class

Glycerophosphoethanolamines

Direct Parent

Glycerophosphoethanolamines

Alternative Parents

Substituents

Sn-glycero-3-phosphoethanolamine
Phosphoethanolamine
Dialkyl phosphate
Organic phosphoric acid derivative
Phosphoric acid ester
Alkyl phosphate
Secondary alcohol
1,2-diol
Primary amine
Primary alcohol
Organic oxygen compound
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Organic oxide
Primary aliphatic amine
Organic nitrogen compound
Amine
Organopnictogen compound
Alcohol
Aliphatic acyclic compound

Molecular Framework

Aliphatic acyclic compounds

External Descriptors

sn-glycerol 3-phosphates (CHEBI:52330 )
phosphoethanolamine (CHEBI:52330 )

Ontology

Not Available

Feces (PMID: 27543620)

Cellular substructure

Cytoplasm (HMDB: HMDB0000114)

Source

Endogenous

Endogenous (HMDB: HMDB0000114)

Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Equine

Horse (FooDB: FOOD00378)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Phospholipid Biosynthesis (PathBank: SMP0063652)

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	29.2 g/L	ALOGPS
logP	-2.3	ALOGPS
logP	-3.4	ChemAxon
logS	-0.77	ALOGPS
pKa (Strongest Acidic)	1.87	ChemAxon
pKa (Strongest Basic)	10	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	5	ChemAxon
Hydrogen Donor Count	4	ChemAxon
Polar Surface Area	122.24 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	43.82 m³·mol⁻¹	ChemAxon
Polarizability	19.07 Å³	ChemAxon
Number of Rings	0	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	141.613	30932474
DeepCCS	[M-H]-	137.786	30932474
DeepCCS	[M-2H]-	175.407	30932474
DeepCCS	[M+Na]+	150.745	30932474
AllCCS	[M+H]+	146.0	32859911
AllCCS	[M+H-H2O]+	142.5	32859911
AllCCS	[M+NH4]+	149.2	32859911
AllCCS	[M+Na]+	150.1	32859911
AllCCS	[M-H]-	142.4	32859911
AllCCS	[M+Na-2H]-	143.8	32859911
AllCCS	[M+HCOO]-	145.5	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Glycerylphosphorylethanolamine	NCCOP(O)(=O)OCC(O)CO	2766.6	Standard polar	33892256
Glycerylphosphorylethanolamine	NCCOP(O)(=O)OCC(O)CO	1798.5	Standard non polar	33892256
Glycerylphosphorylethanolamine	NCCOP(O)(=O)OCC(O)CO	1882.5	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Glycerylphosphorylethanolamine,1TMS,isomer #1	C[Si](C)(C)OC(CO)COP(=O)(O)OCCN	1961.8	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TMS,isomer #2	C[Si](C)(C)OCC(O)COP(=O)(O)OCCN	1951.1	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TMS,isomer #3	C[Si](C)(C)OP(=O)(OCCN)OCC(O)CO	1950.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TMS,isomer #4	C[Si](C)(C)NCCOP(=O)(O)OCC(O)CO	2056.0	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(O)OCCN)O[Si](C)(C)C	2000.5	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #2	C[Si](C)(C)OC(CO)COP(=O)(OCCN)O[Si](C)(C)C	1977.3	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #3	C[Si](C)(C)NCCOP(=O)(O)OCC(CO)O[Si](C)(C)C	2049.3	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #4	C[Si](C)(C)OCC(O)COP(=O)(OCCN)O[Si](C)(C)C	1970.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #5	C[Si](C)(C)NCCOP(=O)(O)OCC(O)CO[Si](C)(C)C	2043.5	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #6	C[Si](C)(C)NCCOP(=O)(OCC(O)CO)O[Si](C)(C)C	2060.5	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TMS,isomer #7	C[Si](C)(C)N(CCOP(=O)(O)OCC(O)CO)[Si](C)(C)C	2217.7	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C)O[Si](C)(C)C	2002.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C)O[Si](C)(C)C	1949.5	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C)O[Si](C)(C)C	2636.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #2	C[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C)O[Si](C)(C)C	2053.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #2	C[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C)O[Si](C)(C)C	2070.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #2	C[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C)O[Si](C)(C)C	2733.4	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #3	C[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C)O[Si](C)(C)C	2065.8	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #3	C[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C)O[Si](C)(C)C	2095.9	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #3	C[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C)O[Si](C)(C)C	2415.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #4	C[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2230.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #4	C[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2161.9	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #4	C[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2831.8	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #5	C[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C)O[Si](C)(C)C	2064.1	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #5	C[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C)O[Si](C)(C)C	2083.2	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #5	C[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C)O[Si](C)(C)C	2369.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #6	C[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2217.0	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #6	C[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2177.3	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #6	C[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C	2780.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #7	C[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)OCC(O)CO	2215.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #7	C[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)OCC(O)CO	2163.3	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TMS,isomer #7	C[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)OCC(O)CO	2522.5	Standard polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #1	C[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2066.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #1	C[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2108.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #1	C[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2226.9	Standard polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #2	C[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2234.8	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #2	C[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2189.1	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #2	C[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2561.9	Standard polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #3	C[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2233.1	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #3	C[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2206.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #3	C[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2334.1	Standard polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #4	C[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2219.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #4	C[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2203.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TMS,isomer #4	C[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C	2298.6	Standard polar	33892256
Glycerylphosphorylethanolamine,5TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2226.7	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,5TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2212.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,5TMS,isomer #1	C[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C	2198.3	Standard polar	33892256
Glycerylphosphorylethanolamine,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(O)OCCN	2179.4	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(O)OCCN	2174.8	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OP(=O)(OCCN)OCC(O)CO	2189.1	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(O)CO	2280.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(O)OCCN)O[Si](C)(C)C(C)(C)C	2392.5	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(OCCN)O[Si](C)(C)C(C)(C)C	2367.4	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(CO)O[Si](C)(C)C(C)(C)C	2470.4	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(OCCN)O[Si](C)(C)C(C)(C)C	2372.3	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(O)CO[Si](C)(C)C(C)(C)C	2465.4	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(O)CO)O[Si](C)(C)C(C)(C)C	2495.3	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)N(CCOP(=O)(O)OCC(O)CO)[Si](C)(C)C(C)(C)C	2617.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2591.7	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2465.6	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2781.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2668.5	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2641.5	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)NCCOP(=O)(O)OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2917.7	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2679.3	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2602.7	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2672.5	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2860.9	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2704.7	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2956.1	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2682.8	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2621.9	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(O)CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2655.4	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2858.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2734.5	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C	2936.7	Standard polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OCC(O)CO	2851.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OCC(O)CO	2685.2	Standard non polar	33892256
Glycerylphosphorylethanolamine,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)OCC(O)CO	2737.7	Standard polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2900.6	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2756.7	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NCCOP(=O)(OCC(CO[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2622.3	Standard polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3110.1	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2895.7	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC(COP(=O)(O)OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2826.5	Standard polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3072.0	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2838.8	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(CO)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2656.7	Standard polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3071.2	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2843.6	Standard non polar	33892256
Glycerylphosphorylethanolamine,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC(O)COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2643.2	Standard polar	33892256
Glycerylphosphorylethanolamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	3313.0	Semi standard non polar	33892256
Glycerylphosphorylethanolamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2985.7	Standard non polar	33892256
Glycerylphosphorylethanolamine,5TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC(COP(=O)(OCCN([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C	2658.5	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (Non-derivatized) - 70eV, Positive	splash10-0gwf-5900000000-55796a83071cae1bff8b	2016-09-22	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_1_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_1_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_1_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_1_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_1) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_2) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_3) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_4) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_5) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_6) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Glycerylphosphorylethanolamine GC-MS (TBDMS_2_7) - 70eV, Positive	Not Available	2021-11-05	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 10V, Positive-QTOF	splash10-0006-9110000000-687d834f521d42c7e36c	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 20V, Positive-QTOF	splash10-0006-9100000000-f3f7dcb5cdd10c48a24a	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 40V, Positive-QTOF	splash10-052f-9000000000-750b47541e6949c8a75f	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 10V, Negative-QTOF	splash10-03di-2950000000-9e71c620f3a5db1afe86	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 20V, Negative-QTOF	splash10-004l-9700000000-823f904dfffc25785d54	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 40V, Negative-QTOF	splash10-004i-9000000000-fdc87551301ed4f6a009	2015-09-15	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 10V, Positive-QTOF	splash10-0006-9710000000-e0cffde8c86999d55b58	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 20V, Positive-QTOF	splash10-0007-9100000000-3885584fdb3534a0f84e	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 40V, Positive-QTOF	splash10-0006-9000000000-36cf29cb44eeb3400dfa	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 10V, Negative-QTOF	splash10-0h00-9460000000-32cd47677e60fcdcf101	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 20V, Negative-QTOF	splash10-004i-9300000000-30cffc72754975634160	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Glycerylphosphorylethanolamine 40V, Negative-QTOF	splash10-004i-9000000000-ca30e71e114ea6673088	2021-09-24	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-16	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm

Biospecimen Locations

Blood
Feces
Urine

Tissue Locations

Brain
Liver
Placenta
Prostate

Pathways

Name	SMPDB/PathBank	KEGG
Phospholipid Biosynthesis

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Feces	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	27543620	details
Feces	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	29808030	details

Abnormal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Asthma	33739820	details
Urine	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Asthma	33739820	details

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB021895

KNApSAcK ID

Not Available

Chemspider ID

110410

KEGG Compound ID

C01233

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

5151

PubChem Compound

123874

PDB ID

Not Available

ChEBI ID

52330

Food Biomarker Ontology

Not Available

VMH ID

M02913

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Tronconi, Giovanni. Process for the chromatographic isolation of 1-(a)-glycerylphosphorylcholine and of L-(a)-glycerylphosphorylethanolamine. PCT Int. Appl. (1990), 18 pp.

Material Safety Data Sheet (MSDS)

Not Available

General References

Sreekumar A, Poisson LM, Rajendiran TM, Khan AP, Cao Q, Yu J, Laxman B, Mehra R, Lonigro RJ, Li Y, Nyati MK, Ahsan A, Kalyana-Sundaram S, Han B, Cao X, Byun J, Omenn GS, Ghosh D, Pennathur S, Alexander DC, Berger A, Shuster JR, Wei JT, Varambally S, Beecher C, Chinnaiyan AM: Metabolomic profiles delineate potential role for sarcosine in prostate cancer progression. Nature. 2009 Feb 12;457(7231):910-4. doi: 10.1038/nature07762. [PubMed:19212411 ]
Nitsch RM, Blusztajn JK, Pittas AG, Slack BE, Growdon JH, Wurtman RJ: Evidence for a membrane defect in Alzheimer disease brain. Proc Natl Acad Sci U S A. 1992 Mar 1;89(5):1671-5. [PubMed:1311847 ]
Jensen JE, Drost DJ, Menon RS, Williamson PC: In vivo brain (31)P-MRS: measuring the phospholipid resonances at 4 Tesla from small voxels. NMR Biomed. 2002 Aug;15(5):338-47. [PubMed:12203225 ]
Fallbrook A, Turenne SD, Mamalias N, Kish SJ, Ross BM: Phosphatidylcholine and phosphatidylethanolamine metabolites may regulate brain phospholipid catabolism via inhibition of lysophospholipase activity. Brain Res. 1999 Jul 10;834(1-2):207-10. [PubMed:10407117 ]
Kish SJ, Robitaille Y, Ball M, Gilbert J, Deck JH, Chang LJ, Schut L: Glycerophosphoethanolamine concentration is elevated in brain of patients with dominantly inherited olivopontocerebellar atrophy. Neurosci Lett. 1990 Dec 11;120(2):209-11. [PubMed:2293106 ]
Perry TL, Hansen S, Gandham SS: Postmortem changes of amino compounds in human and rat brain. J Neurochem. 1981 Feb;36(2):406-10. [PubMed:7463068 ]
Nelson C, Moffat B, Jacobsen N, Henzel WJ, Stults JT, King KL, McMurtrey A, Vandlen R, Spencer SA: Glycerophosphorylethanolamine (GPEA) identified as an hepatocyte growth stimulator in liver extracts. Exp Cell Res. 1996 Nov 25;229(1):20-6. [PubMed:8940245 ]
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Enzymes

Enzyme Details

1. Acyl-protein thioesterase 1

General function:: Involved in hydrolase activity
Specific function:: Hydrolyzes fatty acids from S-acylated cysteine residues in proteins such as trimeric G alpha proteins or HRAS. Has depalmitoylating activity and also low lysophospholipase activity.
Gene Name:: LYPLA1
Uniprot ID:: O75608
Molecular weight:: 24669.355

Enzyme Details

2. Group XV phospholipase A2

General function:: Involved in phosphatidylcholine-sterol O-acyltransferase activity
Specific function:: Has transacylase and calcium-independent phospholipase A2 activity. Catalyzes the formation of 1-O-acyl-N-acetylsphingosine and the concomitant release of a lyso-phospholipid (By similarity). May have weak lysophospholipase activity.
Gene Name:: PLA2G15
Uniprot ID:: Q8NCC3
Molecular weight:: Not Available

Enzyme Details

3. Cytosolic phospholipase A2

General function:: Involved in metabolic process
Specific function:: Selectively hydrolyzes arachidonyl phospholipids in the sn-2 position releasing arachidonic acid. Together with its lysophospholipid activity, it is implicated in the initiation of the inflammatory response.
Gene Name:: PLA2G4A
Uniprot ID:: P47712
Molecular weight:: 85210.19

Enzyme Details

4. Acyl-protein thioesterase 2

General function:: Involved in hydrolase activity
Specific function:: May hydrolyze fatty acids from S-acylated cysteine residues in proteins such as trimeric G alpha proteins or HRAS. Has lysophospholipase activity (By similarity). Deacylates GAP43.
Gene Name:: LYPLA2
Uniprot ID:: O95372
Molecular weight:: 24736.71

Enzyme Details

5. Eosinophil lysophospholipase

General function:: Involved in sugar binding
Specific function:: May have both lysophospholipase and carbohydrate-binding activities.
Gene Name:: CLC
Uniprot ID:: Q05315
Molecular weight:: 16452.785

Enzyme Details

6. Glycerophosphodiester phosphodiesterase 1

General function:: Involved in glycerophosphodiester phosphodiesterase activity
Specific function:: Has glycerophosphoinositol phosphodiesterase activity. Has little or no activity towards glycerophosphocholine. GDE1 activity can be modulated by G-protein signaling pathways (By similarity).
Gene Name:: GDE1
Uniprot ID:: Q9NZC3
Molecular weight:: 37718.04

Enzyme Details

7. MHC class I antigen

General function:: Involved in immune response
Specific function:: Not Available
Gene Name:: HLA-B
Uniprot ID:: Q95372
Molecular weight:: 21058.9

Showing metabocard for Glycerylphosphorylethanolamine (HMDB0000114)

MOL for HMDB0000114 (Glycerylphosphorylethanolamine)

3D MOL for HMDB0000114 (Glycerylphosphorylethanolamine)

3D SDF for HMDB0000114 (Glycerylphosphorylethanolamine)

3D-SDF for HMDB0000114 (Glycerylphosphorylethanolamine)

PDB for HMDB0000114 (Glycerylphosphorylethanolamine)

3D PDB for HMDB0000114 (Glycerylphosphorylethanolamine)

SMILES for HMDB0000114 (Glycerylphosphorylethanolamine)

INCHI for HMDB0000114 (Glycerylphosphorylethanolamine)

Structure for HMDB0000114 (Glycerylphosphorylethanolamine)

3D Structure for HMDB0000114 (Glycerylphosphorylethanolamine)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

Enzymes