Basic information
- CAS
19698-29-4- Standard SMILES
CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCC- InChIKey
PORPENFLTBBHSG-UHFFFAOYSA-N- Molecular formula
- C35H69O8P
- Average molar mass
- 648.9 g/mol
- Monoisotopic mass
- 648.47300615
Overview
Dihexadecanoyl phosphatidic acid is a phosphatidic acid in which the phosphatidyl acyl groups are both palmitoyl (hexadecanoyl). It is functionally related to a hexadecanoic acid.
Names & identifiers
- Preferred name
- Dipalmitoylphosphatidic acid
- IUPAC
- (2-hexadecanoyloxy-3-phosphonooxypropyl) hexadecanoate
Names & synonyms
dipalmitoylphosphatidic acid19698-29-4RefChem:785993243-238-21,2-dipalmitoyl-sn-glycero-3-phosphate2,3-Bis(palmitoyloxy)propyl dihydrogen phosphatedihexadecanoyl phosphatidic acidPalmitin, 1,2-di-, dihydrogen phosphate3-(phosphonooxy)propane-1,2-diyl dihexadecanoateHexadecanoic acid, 1-[(phosphonooxy)methyl]-1,2-ethanediyl esterDTXSID00864003PORPENFLTBBHSG-UHFFFAOYSA-N
Show more names
1,2-DipalmitoyPA(32:0)EINECS 225-873-7EINECS 243-238-2CBiol_001831BSPBio_001456KBioGR_000176KBioSS_000176
Database identifiers
- CAS
19698-29-4、5129-68-0- PubChem CID
- 3099
- DTXSID
DTXSID00864003- ChEMBL
CHEMBL1606485- ChEBI
CHEBI:78105- EC Number
- 225-873-7、243-238-2
- Nikkaji
- J225.252J
Properties
Computed structural properties
- XLogP
- 12.9
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 36
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 696
Experimental & physicochemical properties
LipidsLipids -> Glycerophospholipids [GP] -> Glycerophosphates [GP10] -> Diacylglycerophosphates [GP1001]
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Hexadecanoic acid, 1-[(phosphonooxy)methyl]-1,2-ethanediyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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