Skip Navigation Links
ScientificNameLabel
2,3-dihydroxypropylpalmitate
PHCD compound ID : 1710
Chemical Names :
2,3-dihydroxypropylpalmitate
Molecular Formula : C19H38O4
Molecular Weight : 330.27701
More Details :
Names & Synonyms: [(2R)-2,3-dihydroxypropyl] hexadecanoate , hexadecanoic acid [(2R)-2,3-dihydroxypropyl] ester , [(2R)-2,3-bis(oxidanyl)propyl] hexadecanoate , palmitic acid [(2R)-2,3-dihydroxypropyl] ester
Smiles: CCCCCCCCCCCCCCCC(=O)OC[C@@H](CO)O
InChi : InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3/t18-/m1/s1
InChi Key : InChIKey=QHZLMUACJMDIAE-GOSISDBHSA-N
PubChem ID : 11359451
Rotatable bond count : 18 Rule of five : 2
Hydrogen bond acceptor count : 4 Ionization potential : 10.498818
Hydrogen bond donor count : 2 Electric dipole moment : 3.254
XLogP : 6.51 VDW volume : 369.704615
Molecular weight : 330.27701 HOMO-LUMO gap : 11.183000
Herb list :
Refrences & Litretures:
  
193.      Journal:'Journal of Chinese Pharmaceutical Sciences'      Year:'2007'      Volume:'16'      Page:'288'      DOI:'1003–1057(2007)4–288–06'      Title:'Chemical constituents of the flower buds of Tussilago farfara'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us