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ScientificNameLabel
incensyl acetate
PHCD compound ID : 5519
Chemical Names :
incensyl acetate
Molecular Formula : C22H36O3
Molecular Weight : 348.266445
More Details :
Names & Synonyms:
Smiles: CC(=O)O[C@H]1CC/C(=C/CC/C(=C/C[C@]2(O[C@]1(C)CC2)C(C)C)/C)/C
InChi : InChI=1S/C22H36O3/c1-16(2)22-13-12-18(4)9-7-8-17(3)10-11-20(24-19(5)23)21(6,25-22)14-15-22/h8,12,16,20H,7,9-11,13-15H2,1-6H3/b17-8+,18-12+/t20-,21+,22+/m0/s1
InChi Key : InChIKey=HVBACKJYWZTKCA-XSLBTUIJSA-N
PubChem ID :
Rotatable bond count : 3 Rule of five : 1
Hydrogen bond acceptor count : 3 Ionization potential : 8.664129
Hydrogen bond donor count : 0 Electric dipole moment : 3.191
XLogP : 5.316 VDW volume : 382.816507
Molecular weight : 348.266445 HOMO-LUMO gap : 9.853000
Herb list :
Refrences & Litretures:
  
926.      Journal:'ISRN Analytical Chemistry'      Year:'2014'      Volume:''      Page:'374678'      DOI:'10.1155/2014/374678'      Title:'Comparative Phytochemical Analyses of Resins of Boswellia Species (B. papyrifera (Del.) Hochst., B. neglecta S. Moore, and B. rivae Engl.) from Northwestern, Southern, and Southeastern Ethiopia'
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