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Beta-Duprezianene
ScientificNameLabel
Beta-Duprezianene
PHCD compound ID :
1498
Chemical Names :
Beta-Duprezianene
Molecular Formula :
C15H24
Molecular Weight :
204.187801
More Details :
Names & Synonyms:
Smiles:
C=C1C[C@]23CC[C@@H]1C([C@@H]3CC[C@H]2C)(C)C
InChi :
InChI=1S/C15H24/c1-10-9-15-8-7-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12+,13+,15-/m1/s1
InChi Key :
InChIKey=SODGFMASLAAZRW-UKTARXLSSA-N
PubChem ID :
91750164
Rotatable bond count :
0
Rule of five :
1
Hydrogen bond acceptor count :
0
Ionization potential :
9.431567
Hydrogen bond donor count :
0
Electric dipole moment :
0.943
XLogP :
6.642
VDW volume :
228.290393
Molecular weight :
204.187801
HOMO-LUMO gap :
10.818000
Herb list :
Violet - Viola odorata - بنفشه معطر، بنفشه
Refrences & Litretures:
161. Journal:'Archives of Applied Science Research' Year:'2011' Volume:'3' Page:'44' DOI:'' Title:'Biocontrol of Botrytis cinerea with essential oil and methanol extract of Viola odorata L. flowers'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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