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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(1aR,4S,4aR,7R,7aS,7bS)-1,1,7-trimethylspiro[2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene-4,2'-oxirane] , (1aR,4S,4aR,7R,7aS,7bS)-1,1,7-trimethylspiro[2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene-4,2'-oxirane] , (1aR,4S,4aR,7R,7aS,7bS)-1,1,7-trimethylspiro[2,3,4a,5,6,7,7a,7b-octahydro-1aH-cycloprop[e]azulene-4,2'-oxirane]
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| Smiles: |
C[C@@H]1CC[C@@H]2[C@@H]1[C@H]1[C@H](C1(C)C)CC[C@@]12OC1
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| InChi : |
InChI=1S/C15H24O/c1-9-4-5-10-12(9)13-11(14(13,2)3)6-7-15(10)8-16-15/h9-13H,4-8H2,1-3H3/t9-,10-,11-,12-,13-,15-/m1/s1
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| InChi Key : |
InChIKey=XPGWKKLDFXNBPJ-QTPLKFIXSA-N
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| PubChem ID : |
16211192
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| Rotatable bond count : |
0
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
1
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Ionization potential : |
9.893992
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
1.558
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| XLogP : |
4.964
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VDW volume : |
227.36062
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| Molecular weight : |
220.182715
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HOMO-LUMO gap : |
12.327000
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| Herb list : |
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| Refrences & Litretures: |
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