Stearoylglycerone phosphate
Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(=O)COP(=O)(O)O- InChIKey
GTPATKZCXDKGQS-UHFFFAOYSA-N- Molecular formula
- C21H41O7P
- Average molar mass
- 436.5 g/mol
- Monoisotopic mass
- 436.25899064
Overview
1-stearoylglycerone 3-phosphate is a 1-acylglycerone 3-phosphate. It is functionally related to a dihydroxyacetone. It is a conjugate acid of a 1-stearoylglycerone 3-phosphate(2-).
Names & identifiers
- Preferred name
- Stearoylglycerone phosphate
- IUPAC
- (2-oxo-3-phosphonooxypropyl) octadecanoate
Names & synonyms
Stearoylglycerone phosphate(2-oxo-3-phosphonooxypropyl) octadecanoateRefChem:1854151-stearoylglycerone 3-phosphateDHAP(18:0)[3-(octadecanoyloxy)-2-oxopropoxy]phosphonic acid1-Octadecanoyl DHAPC03805SCHEMBL30724146CHEBI:36476DTXSID1013448341-Octadecanoyl-glycerone-3-phosphate
Show more names
1-Octadecanoyl Dihydroxyacetone phosphate2-oxo-3-(phosphonooxy)propyl octadecanoate
Database identifiers
- PubChem CID
- 440127
- DTXSID
DTXSID101344834- ChEBI
CHEBI:36476- Nikkaji
- J2.749.477C
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 22
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 462
Experimental & physicochemical properties
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Metabolite PathwaysPlasmalogen Synthesis
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Related reactions
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Compound notes
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