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ScientificNameLabel
Pentacosanal
PHCD compound ID : 927
Chemical Names :
Pentacosanal
Molecular Formula : C25H50O1
Molecular Weight : 366.386166
More Details :
Names & Synonyms: pentacosanal
Smiles: CCCCCCCCCCCCCCCCCCCCCCCCC=O
InChi : InChI=1S/C25H50O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26/h25H,2-24H2,1H3
InChi Key : InChIKey=HAGKFWXVDSAFHB-UHFFFAOYSA-N
PubChem ID : 181174
Rotatable bond count : 23 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.108721
Hydrogen bond donor count : 0 Electric dipole moment : 2.966
XLogP : 13.105 VDW volume : 447.109842
Molecular weight : 366.386166 HOMO-LUMO gap : 10.881000
Herb list :
Refrences & Litretures:
  
74.      Journal:'Food Chemistry'      Year:'1998'      Volume:'63'      Page:'373'      DOI:''      Title:'Study of the composition of the different parts of a Spanish Thymes vulgaris L. plant'
542.      Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech'      Year:'2015'      Volume:'320'      Page:'95'      DOI:''      Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
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