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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(1R,2S,3R)-8-azabicyclo[3.2.1]octane-1,2,3-triol , (1R,2S,3R)-8-azabicyclo[3.2.1]octane-1,2,3-triol
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| Smiles: |
O[C@@H]1C[C@H]2CC[C@@]([C@H]1O)(N2)O
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| InChi : |
InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5-,6+,7-/m1/s1
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| InChi Key : |
InChIKey=XOCBOVUINUHZJA-MVIOUDGNSA-N
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| PubChem ID : |
45109777
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| Rotatable bond count : |
0
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
4
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Ionization potential : |
9.607385
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| Hydrogen bond donor count : |
4
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Electric dipole moment : |
1.529
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| XLogP : |
-0.083
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VDW volume : |
142.282874
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| Molecular weight : |
159.089543
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HOMO-LUMO gap : |
11.780000
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| Herb list : |
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| Refrences & Litretures: |
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