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ScientificNameLabel
epi-cis-Dihydroagarofuran
PHCD compound ID : 808
Chemical Names :
epi-cis-Dihydroagarofuran
Molecular Formula : C15H26O1
Molecular Weight : 222.198365
More Details :
Names & Synonyms:
Smiles: C[C@@H]1CCC[C@]2([C@]31C[C@@H](C(O3)(C)C)CC2)C
InChi : InChI=1S/C15H26O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h11-12H,5-10H2,1-4H3/t11-,12+,14-,15-/m1/s1
InChi Key : InChIKey=HVAVUZLEYSAYGE-AYRXBEOTSA-N
PubChem ID : 521889
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.201494
Hydrogen bond donor count : 0 Electric dipole moment : 1.289
XLogP : 4.171 VDW volume : 239.717079
Molecular weight : 222.198365 HOMO-LUMO gap : 11.983000
Herb list :
Refrences & Litretures:
  
57.      Journal:'Intl. Res. J. Appl. Basic. Sci'      Year:'2012'      Volume:'3'      Page:'919'      DOI:''      Title:'Bitter and Sweet Ferula assa-foetida L. Essential oil Composition from Iran and its Comparison with Ferula assa-foetida L. used in India'
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