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ScientificNameLabel
Alpha-14-Oxymuurolene
PHCD compound ID : 394
Chemical Names :
Alpha-14-Oxymuurolene
Molecular Formula : C15H22O1
Molecular Weight : 218.167065
More Details :
Names & Synonyms: 4-isopropyl-6-methyl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carbaldehyde , 6-methyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carboxaldehyde , 6-methyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalene-1-carbaldehyde
Smiles: O=CC1=CC[C@@H]([C@H]2[C@@H]1CCC(=C2)C)C(C)C
InChi : InChI=1S/C15H22O/c1-10(2)13-7-5-12(9-16)14-6-4-11(3)8-15(13)14/h5,8-10,13-15H,4,6-7H2,1-3H3/t13-,14-,15+/m1/s1
InChi Key : InChIKey=DNHAZRYDTSOZHV-KFWWJZLASA-N
PubChem ID : 91746681
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.172664
Hydrogen bond donor count : 0 Electric dipole moment : 3.203
XLogP : 4.523 VDW volume : 244.164161
Molecular weight : 218.167065 HOMO-LUMO gap : 9.240000
Herb list :
Refrences & Litretures:
  
22.      Journal:'Z Lebensm Unters Forsch A'      Year:'1999'      Volume:'208'      Page:'212'      DOI:''      Title:'Effect of extraction techniques on the chemical composition and antioxidant activity of Eucalyptus camaldulensis var. brevirostris leaf oils'
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