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15:0-18:1 DG

CAT: 0013-GTR19256209-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19256209-01Size:10 mg
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Description
15:0-18:1 DG is a form of diacylglycerol (DAG) . It is produced by the hydrolysis of triacylglycerol (TAG) found in butter. This compound shows potential for research in obesity, cardiovascular diseases, and dietary interventions.
CAS Number
67889-40-1
Field of Research
Metabolism Research
Smiles
[C@@H] (OC (CCCCCCC/C=C\CCCCCCCC) =O) (COC (CCCCCCCCCCCCCC) =O) CO
Molecular Formula
C36H68O5
Molecular Weight
580.922
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-pentadecanoyl-2-(9Z-octadecenoyl)-sn-glycerol

DG(15:0/18:1(9Z)/0:0) is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).

CAS Number67889-40-1
PubChem CID14275367
IUPAC Name[(2S)-1-hydroxy-3-pentadecanoyloxypropan-2-yl] (Z)-octadec-9-enoate
Molecular FormulaC36H68O5
Molecular Weight580.9
XLogP13.7
Topological Polar Surface Area72.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count34
Heavy Atom Count41
Formal Charge0
Complexity589
SMILES
CCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C36H68O5/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-36(39)41-34(32-37)33-40-35(38)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h17-18,34,37H,3-16,19-33H2,1-2H3/b18-17-/t34-/m0/s1
InChIKey
GWAPRYUVSHVZHN-PDGPHRJUSA-N
Chemical Structure
2D Structure
2D structure of 1-pentadecanoyl-2-(9Z-octadecenoyl)-sn-glycerol
CAS: 67889-40-1
CID: 14275367
Formula: C36H68O5
MW: 580.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight580.9
XLogP313.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count34
Exact Mass580.50667527
Monoisotopic Mass580.50667527
Topological Polar Surface Area72.8 Ų
Heavy Atom Count41
Formal Charge0
Complexity589
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes