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ScientificNameLabel
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More Details :
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| Names & Synonyms: |
(2R,3R,4S,5S,6R)-2-ethoxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol , (2R,3R,4S,5S,6R)-2-ethoxy-6-(hydroxymethyl)oxane-3,4,5-triol , (2R,3R,4S,5S,6R)-2-ethoxy-6-methylol-tetrahydropyran-3,4,5-triol
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| Smiles: |
CCO[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O
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| InChi : |
InChI=1S/C8H16O6/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8/h4-12H,2-3H2,1H3/t4-,5-,6+,7-,8-/m1/s1
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| InChi Key : |
InChIKey=WYUFTYLVLQZQNH-JAJWTYFOSA-N
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| PubChem ID : |
121667
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| Rotatable bond count : |
3
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Rule of five : |
0
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| Hydrogen bond acceptor count : |
6
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Ionization potential : |
10.306530
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| Hydrogen bond donor count : |
4
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Electric dipole moment : |
0.738
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| XLogP : |
-1.184
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VDW volume : |
187.309237
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| Molecular weight : |
208.094688
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HOMO-LUMO gap : |
11.578000
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| Herb list : |
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| Refrences & Litretures: |
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