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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(4aS,7S,8aR)-7-isopropenyl-4a-methyl-1-methylene-decalin , (3S,4aR,8aS)-8a-methyl-5-methylene-3-(1-methylethenyl)-1,2,3,4,4a,6,7,8-octahydronaphthalene , (3S,4aR,8aS)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene , (3S,4aR,8aS)-8a-methyl-5-methylidene-3-prop-1-en-2-yl-1,2,3,4,4a,6,7,8-octahydronaphthalene
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| Smiles: |
C=C1CCC[C@@]2([C@@H]1C[C@H](CC2)C(=C)C)C
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| InChi : |
InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h13-14H,1,3,5-10H2,2,4H3/t13-,14+,15-/m0/s1
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| InChi Key : |
InChIKey=YOVSPTNQHMDJAG-ZNMIVQPWSA-N
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| PubChem ID : |
28237
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| Rotatable bond count : |
1
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Rule of five : |
1
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| Hydrogen bond acceptor count : |
0
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Ionization potential : |
9.544720
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| Hydrogen bond donor count : |
0
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Electric dipole moment : |
1.362
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| XLogP : |
6.19
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VDW volume : |
238.010393
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| Molecular weight : |
204.187801
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HOMO-LUMO gap : |
10.819000
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| Herb list : |
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| Refrences & Litretures: |
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