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ScientificNameLabel
Glyceryl linoleate
PHCD compound ID : 1303
Chemical Names :
1-O-(9Z,12Z-octadecadienoyl)glycerol , Glyceryl linoleate
Molecular Formula : C21H38O4
Molecular Weight : 354.27701
More Details :
Names & Synonyms: 2,3-dihydroxypropyl (9Z,12Z)-octadeca-9,12-dienoate , (9Z,12Z)-octadeca-9,12-dienoic acid 2,3-dihydroxypropyl ester , 2,3-bis(oxidanyl)propyl (9Z,12Z)-octadeca-9,12-dienoate , (9Z,12Z)-octadeca-9,12-dienoic acid glyceryl ester
Smiles: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](CO)O
InChi : InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-/t20-/m0/s1
InChi Key : InChIKey=WECGLUPZRHILCT-GSNKCQISSA-N
PubChem ID : 5283469
Rotatable bond count : 18 Rule of five : 2
Hydrogen bond acceptor count : 4 Ionization potential : 9.481913
Hydrogen bond donor count : 2 Electric dipole moment : 4.453
XLogP : 6.805 VDW volume : 399.023667
Molecular weight : 354.27701 HOMO-LUMO gap : 10.181000
Herb list :
Refrences & Litretures:
  
139.      Journal:'Res. J. Seed Sci'      Year:'2010'      Volume:'3'      Page:'210'      DOI:''      Title:'Bioactive Non-alkaloidal Secondary Metabolites of Hyoscyamus niger Linn. Seeds: A Review'
377.      Journal:'Pharmaceutical Biology'      Year:'2011'      Volume:'49'      Page:'756'      DOI:'10.3109/13880209.2010.547206'      Title:'Chemical constituents and bioactivities of the liposoluble fraction from different medicinal parts of Crocus sativus'
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