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ScientificNameLabel
lyratol
PHCD compound ID : 1467
Chemical Names :
lyratol
Molecular Formula : C10H16O1
Molecular Weight : 152.120115
More Details :
Names & Synonyms: (2E)-2,5-dimethyl-4-vinyl-hexa-2,5-dien-1-ol , (2E)-4-ethenyl-2,5-dimethyl-1-hexa-2,5-dienol , (2E)-4-ethenyl-2,5-dimethylhexa-2,5-dien-1-ol , (2E)-4-ethenyl-2,5-dimethyl-hexa-2,5-dien-1-ol
Smiles: C=C[C@@H](C(=C)C)/C=C(/CO)\C
InChi : InChI=1S/C10H16O/c1-5-10(8(2)3)6-9(4)7-11/h5-6,10-11H,1-2,7H2,3-4H3/b9-6+/t10-/m1/s1
InChi Key : InChIKey=NHJXCMQPMLBAMK-OLKPEBQYSA-N
PubChem ID : 5462982
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.691230
Hydrogen bond donor count : 1 Electric dipole moment : 1.347
XLogP : 2.403 VDW volume : 182.397156
Molecular weight : 152.120115 HOMO-LUMO gap : 10.438000
Herb list :
Refrences & Litretures:
  
156.      Journal:'Annals of Biological Research'      Year:'2012'      Volume:'3'      Page:'385'      DOI:''      Title:'The Essential Oil Composition of Artemisia vulgaris L. in Iran'
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