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ScientificNameLabel
Silphiperfol-6-en-5-one
PHCD compound ID : 1695
Chemical Names :
Silphiperfol-6-en-5-one
Molecular Formula : C15H22O1
Molecular Weight : 218.167065
More Details :
Names & Synonyms:
Smiles: C[C@H]1CC[C@]23[C@@H]1CC[C@]3(C)C(=O)C(=C2C)C
InChi : InChI=1S/C15H22O/c1-9-5-8-15-11(3)10(2)13(16)14(15,4)7-6-12(9)15/h9,12H,5-8H2,1-4H3/t9-,12+,14+,15+/m0/s1
InChi Key : InChIKey=WRSMTJOLBOXBOD-ZEQHWRKHSA-N
PubChem ID : 91750907
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.469053
Hydrogen bond donor count : 0 Electric dipole moment : 3.839
XLogP : 3.364 VDW volume : 234.444161
Molecular weight : 218.167065 HOMO-LUMO gap : 9.667000
Herb list :
Refrences & Litretures:
  
190.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2011'      Volume:'14'      Page:'413'      DOI:''      Title:'Volatile Oils of Flowers and Stems of Tussilago farfara L. from Lithuania'
861.      Journal:'Arabian Journal of Chemistry'      Year:'2016'      Volume:'9'      Page:'S1190'      DOI:'10.1016/j.arabjc.2012.01.003'      Title:'Variation in essential oil composition of Iris nigricans Dinsm. (Iridaceae) endemic to Jordan at di?erent ?owering stages'
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