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ScientificNameLabel
10-Methyl-E-11-tridecen-1-ol propionate
PHCD compound ID : 5109
Chemical Names :
10-Methyl-E-11-tridecen-1-ol propionate
Molecular Formula : C17H32O2
Molecular Weight : 268.24023
More Details :
Names & Synonyms: [(E)-10-methyltridec-11-enyl] propanoate , propanoic acid [(E)-10-methyltridec-11-enyl] ester , [(E)-10-methyltridec-11-enyl] propanoate , propionic acid [(E)-10-methyltridec-11-enyl] ester
Smiles: C/C=C/[C@@H](CCCCCCCCCOC(=O)CC)C
InChi : InChI=1S/C17H32O2/c1-4-13-16(3)14-11-9-7-6-8-10-12-15-19-17(18)5-2/h4,13,16H,5-12,14-15H2,1-3H3/b13-4+/t16-/m0/s1
InChi Key : InChIKey=MNSWPRRRHUHTHI-DQNFTHGOSA-N
PubChem ID : 5365029
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.599049
Hydrogen bond donor count : 0 Electric dipole moment : 2.037
XLogP : 7.058 VDW volume : 314.895733
Molecular weight : 268.24023 HOMO-LUMO gap : 10.808000
Herb list :
Refrences & Litretures:
  
806.      Journal:'Immunopharmacology and Immunotoxicology'      Year:'2012'      Volume:'34'      Page:'205'      DOI:'10.3109/08923973.2011.592534'      Title:'Chemical composition, antioxidant activity and larvicidal efects of essential oil from leaves of Apium graveolens'
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