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ScientificNameLabel
Curdione
PHCD compound ID : 2949
Chemical Names :
Curdione
Molecular Formula : C15H24O2
Molecular Weight : 236.17763
More Details :
Names & Synonyms: (3S,6E,10S)-3-isopropyl-6,10-dimethyl-cyclodec-6-ene-1,4-dione , (3S,6E,10S)-6,10-dimethyl-3-propan-2-ylcyclodec-6-ene-1,4-dione , (3S,6E,10S)-6,10-dimethyl-3-propan-2-yl-cyclodec-6-ene-1,4-dione , (3S,6E,10S)-3-isopropyl-6,10-dimethyl-cyclodec-6-ene-1,4-quinone
Smiles: CC1=CCC[C@H](C)C(=O)C[C@H](C(=O)C1)C(C)C
InChi : InChI=1S/C15H24O2/c1-10(2)13-9-14(16)12(4)7-5-6-11(3)8-15(13)17/h6,10,12-13H,5,7-9H2,1-4H3/b11-6+/t12-,13-/m0/s1
InChi Key : InChIKey=KDPFMRXIVDLQKX-NHFJXKHHSA-N
PubChem ID : 6441391
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.385730
Hydrogen bond donor count : 0 Electric dipole moment : 1.965
XLogP : 2.522 VDW volume : 265.310847
Molecular weight : 236.17763 HOMO-LUMO gap : 9.980000
Herb list :
Refrences & Litretures:
  
373.      Journal:'Flavour Fragr. J'      Year:'2007'      Volume:'22'      Page:'191'      DOI:'10.1002/ffj.1780'      Title:'Comparison of chemical composition and antifungal activity of Curcuma longa L. leaf oils produced by different water distillation techniques'
374.      Journal:'J. Essent. Oil Res'      Year:'1997'      Volume:'9'      Page:'589'      DOI:'10.1080/10412905.1997.9700783'      Title:'Essential Oils of Curcuma longa L. from Bhutan'
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