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(S) -3-Hydroxypropane-1,2-Diyl Dipalmitate

CAT: 1299-RG-A260168-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A260168-01Size:10 mg
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CAS Number
30334-71-5
Synonyms
(S) -3-hydroxypropane-1,2-diyl dipalmitate
Molecular Formula
C35H68O5
Molecular Weight
568.92
Target Alternative Name
Glycerol
Product Name Synonym
(S) -3-hydroxypropane-1,2-diyl dipalmitate

Chemical Information

1,2-Dipalmitoyl-sn-glycerol

1,2-dipalmitoyl-sn-glycerol is a 1,2-diacyl-sn-glycerol in which both acyl groups are specified as palmitoyl (hexadecanoyl). It has a role as a mouse metabolite. It is a 1,2-diacyl-sn-glycerol and a 1,2-dipalmitoylglycerol.

CAS Number30334-71-5
PubChem CID644078
IUPAC Name[(2S)-2-hexadecanoyloxy-3-hydroxypropyl] hexadecanoate
Molecular FormulaC35H68O5
Molecular Weight568.9
XLogP14
Topological Polar Surface Area72.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count34
Heavy Atom Count40
Formal Charge0
Complexity536
SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCCCCC
InChI
InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3/t33-/m0/s1
InChIKey
JEJLGIQLPYYGEE-XIFFEERXSA-N
Chemical Structure
2D Structure
2D structure of 1,2-Dipalmitoyl-sn-glycerol
CAS: 30334-71-5
CID: 644078
Formula: C35H68O5
MW: 568.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight568.9
XLogP314
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count34
Exact Mass568.50667527
Monoisotopic Mass568.50667527
Topological Polar Surface Area72.8 Ų
Heavy Atom Count40
Formal Charge0
Complexity536
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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