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ScientificNameLabel
Bulnesol
PHCD compound ID : 1232
Chemical Names :
Bulnesol
Molecular Formula : C15H26O1
Molecular Weight : 222.198365
More Details :
Names & Synonyms: 2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)propan-2-ol , 2-(3,8-dimethyl-1,2,3,3a,4,5,6,7-octahydroazulen-5-yl)-2-propanol
Smiles: C[C@@H]1CCC2=C(C)CC[C@H](C[C@@H]12)C(O)(C)C
InChi : InChI=1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h11-12,14,16H,5-9H2,1-4H3/t11-,12-,14+/m1/s1
InChi Key : InChIKey=LGOFSGDSFQNIAT-BZPMIXESSA-N
PubChem ID : 90785
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.763313
Hydrogen bond donor count : 1 Electric dipole moment : 1.797
XLogP : 4.136 VDW volume : 249.437079
Molecular weight : 222.198365 HOMO-LUMO gap : 10.324000
Herb list :
Refrences & Litretures:
  
126.      Journal:'Chemistry of Natural Compounds'      Year:'2005'      Volume:'41'      Page:'311'      DOI:''      Title:'Ferula gummosa FRUITS: AN AROMATIC ANTIMICROBIAL AGENT'
127.      Journal:'J. Essent. Oil Res'      Year:'2002'      Volume:'14'      Page:'420'      DOI:''      Title:'Volatile Oil Constituents of Ferula gummosa Boiss. from Kashan, Iran'
659.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'37'      Page:'479'      DOI:'10.1016/j.indcrop.2011.07.024'      Title:'Chemical composition and antioxidant and antimicrobial activity of essential oil of Artemisia annua L. from Bosnia'
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