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ScientificNameLabel
6-Hydroxycarvotanacetone
PHCD compound ID : 291
Chemical Names :
6-Hydroxycarvotanacetone
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms: 6-hydroxy-5-isopropyl-2-methyl-cyclohex-2-en-1-one , 6-hydroxy-2-methyl-5-propan-2-yl-1-cyclohex-2-enone , 6-hydroxy-2-methyl-5-propan-2-ylcyclohex-2-en-1-one , 2-methyl-6-oxidanyl-5-propan-2-yl-cyclohex-2-en-1-one
Smiles: CC([C@@H]1CC=C(C(=O)[C@H]1O)C)C
InChi : InChI=1S/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h4,6,8,10,12H,5H2,1-3H3/t8-,10-/m0/s1
InChi Key : InChIKey=CSTXLFNLXWTVDQ-WPRPVWTQSA-N
PubChem ID : 72993385
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.066899
Hydrogen bond donor count : 1 Electric dipole moment : 3.654
XLogP : 1.815 VDW volume : 181.467382
Molecular weight : 168.11503 HOMO-LUMO gap : 9.730000
Herb list :
Refrences & Litretures:
  
17.      Journal:'Pharm Biol'      Year:'2013'      Volume:'51'      Page:'888'      DOI:'10.3109/13880209.2013.768676'      Title:'Volatile composition and antimicrobial activity of the essential oil of Artemisia absinthium growing in Western Ghats region of North West Karnataka, India'
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