1-(decanoyloxy)-3-hydroxypropan-2-yl decanoate

• ChemBase ID: 105140
• Molecular Formular: C23H44O5
• Molecular Mass: 400.59246
• Monoisotopic Mass: 400.31887451
• SMILES: CCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCC
• Canonical SMILES: CCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCC)CO
• InChI: InChI=1S/C23H44O5/c1-3-5-7-9-11-13-15-17-22(25)27-20-21(19-24)28-23(26)18-16-14-12-10-8-6-4-2/h21,24H,3-20H2,1-2H3
• InChIKey: GNSDEDOVXZDMKM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(decanoyloxy)-3-hydroxypropan-2-yl decanoate
• IUPAC Traditional name: 1,2-didecanoylglycerol
• Synonyms: 1,2-Didecanoyl-rac-glycerol (c10:0); 1,2-Dicaprin; (±)-1,2-DIDECANOYLGLYCEROL (10:0); 1,2-Didecanoyl-rac-glycerol

Database IDs

• CAS Number: 82950-64-9
• MDL Number: MFCD00036706
• PubChem SID: 162093314
• PubChem CID: 1321

CALCULATED PROPERTIES

• Acid pKa: 14.577784
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 6.6682696
• LogD (pH = 7.4): 6.6682696
• Log P: 6.6682696
• Molar Refractivity: 112.4869 cm^3
• Polarizability: 45.23985 Å^3
• Polar Surface Area: 72.83 Å^2
• Rotatable Bonds: 22
• Lipinski's Rule of Five: false

PROPERTIES

Safety Information

• Storage Condition: 0°C
• German water hazard class: 3
• Storage Temperature: -20°C

Product Information

• Purity: ~99% (TLC); 98%
• Empirical Formula (Hill Notation): C23H44O5

DETAILS

MP Biomedicals - 02158909

Purity: 98%
Promotes protein kinase C in platelets.

Sigma Aldrich - D6389

Biochem/physiol Actions
Cell-permeable activator of protein kinase C in platelets.

REFERENCES

• Go, M., et al., Biochem. Biophys. Res. Commun. , 144 : 598 (1987).
• Lapetina, E.G., et al., J. Biol. Chem. , 260 : 1358 (1985).