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2-Palmitoylglycerol

CAT: 0127-OR1037249Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0127-OR1037249Size:1 Each
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CAS Number
23470-00-0
MDL Number
MFCD00058513
Purity
98%
Smiles
CCCCCCCCCCCCCCCC(OC(CO)CO)=O

Chemical Information

2-Palmitoylglycerol

2-palmitoylglycerol is a 2-monoglyceride where the acyl group is hexadecanoyl (palmitoyl). It has a role as an algal metabolite. It is functionally related to a hexadecanoic acid.

CAS Number23470-00-0
PubChem CID123409
IUPAC Name1,3-dihydroxypropan-2-yl hexadecanoate
Molecular FormulaC19H38O4
Molecular Weight330.5
XLogP6.1
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count18
Heavy Atom Count23
Formal Charge0
Complexity252
SMILES
CCCCCCCCCCCCCCCC(=O)OC(CO)CO
InChI
InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-18(16-20)17-21/h18,20-21H,2-17H2,1H3
InChIKey
BBNYCLAREVXOSG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Palmitoylglycerol
CAS: 23470-00-0
CID: 123409
Formula: C19H38O4
MW: 330.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.5
XLogP36.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count18
Exact Mass330.27700969
Monoisotopic Mass330.27700969
Topological Polar Surface Area66.8 Ų
Heavy Atom Count23
Formal Charge0
Complexity252
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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B6977-252-Palmitoylglycerol
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