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ScientificNameLabel
Heptadecenoic
PHCD compound ID : 1521
Chemical Names :
Heptadecenoic , cis-10-Heptadecenoic
Molecular Formula : C17H32O2
Molecular Weight : 268.24023
More Details :
Names & Synonyms: (Z)-heptadec-10-enoic acid , (Z)-10-heptadecenoic acid
Smiles: CCCCCC/C=C\CCCCCCCCC(=O)O
InChi : InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h7-8H,2-6,9-16H2,1H3,(H,18,19)/b8-7-
InChi Key : InChIKey=GDTXICBNEOEPAZ-FPLPWBNLSA-N
PubChem ID : 5312435
Rotatable bond count : 14 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.667960
Hydrogen bond donor count : 1 Electric dipole moment : 1.557
XLogP : 7.623 VDW volume : 314.895733
Molecular weight : 268.24023 HOMO-LUMO gap : 10.608000
Herb list :
Refrences & Litretures:
  
165.      Journal:'Journal of Chemistry'      Year:'2013'      Volume:''      Page:'126106'      DOI:'10.1155/2013/126106'      Title:'Chemical Composition of Iran’s Pistacia atlantica Cold-Pressed Oil'
484.      Journal:'Food Chemistry'      Year:'2007'      Volume:'104'      Page:'229'      DOI:'10.1016/j.foodchem.2006.11.032'      Title:'Chemical composition and characterisation of seeds from two varieties (pure and hybrid) of Aesculus hippocastanum'
772.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'964'      DOI:'10.1080/0972060X.2012.10662600'      Title:'Difference in Essential Oil Composition of Rhizome of Polygonum bistorta L. from Different Asian Regions and Evaluation of its Antibacterial Activity'
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