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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(2S,3R,4S,5S,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol , (2S,3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol , (2S,3R,4S,5S,6R)-6-methyloltetrahydropyran-2,3,4,5-tetrol
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| Smiles: |
OC[C@H]1O[C@H](O)[C@@H]([C@H]([C@@H]1O)O)O
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| InChi : |
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6+/m1/s1
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| InChi Key : |
InChIKey=WQZGKKKJIJFFOK-DVKNGEFBSA-N
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| PubChem ID : |
79025
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| Rotatable bond count : |
1
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
6
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Ionization potential : |
10.589282
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| Hydrogen bond donor count : |
5
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Electric dipole moment : |
2.282
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| XLogP : |
-1.697
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VDW volume : |
152.717268
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| Molecular weight : |
180.063388
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HOMO-LUMO gap : |
11.696000
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| Herb list : |
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| Refrences & Litretures: |
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