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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(E)-5-(7a-isopropenyl-4,5-dimethyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-yl)-3-methyl-pent-2-en-1-ol , (E)-5-[4,5-dimethyl-7a-(1-methylethenyl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-yl]-3-methyl-2-penten-1-ol , (E)-5-(4,5-dimethyl-7a-prop-1-en-2-yl-2,3,3a,5,6,7-hexahydro-1H-inden-4-yl)-3-methylpent-2-en-1-ol , (E)-5-(4,5-dimethyl-7a-prop-1-en-2-yl-2,3,3a,5,6,7-hexahydro-1H-inden-4-yl)-3-methyl-pent-2-en-1-ol
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| Smiles: |
OC/C=C(/CC[C@@]1(C)[C@H](C)CC[C@@]2([C@H]1CCC2)C(=C)C)\C
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| InChi : |
InChI=1S/C20H34O/c1-15(2)20-11-6-7-18(20)19(5,17(4)9-13-20)12-8-16(3)10-14-21/h10,17-18,21H,1,6-9,11-14H2,2-5H3/b16-10+/t17-,18+,19+,20-/m1/s1
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| InChi Key : |
InChIKey=BGKGISCHOLIBDN-XBONJJDJSA-N
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| PubChem ID : |
5375222
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| Rotatable bond count : |
5
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Rule of five : |
1
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| Hydrogen bond acceptor count : |
1
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Ionization potential : |
9.478283
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| Hydrogen bond donor count : |
1
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Electric dipole moment : |
2.047
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| XLogP : |
7.211
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VDW volume : |
333.280543
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| Molecular weight : |
290.260966
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HOMO-LUMO gap : |
10.487000
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| Herb list : |
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| Refrences & Litretures: |
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