General Information of the Compound
| Compound ID |
CP0116718
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| Compound Name |
(2R,3R,4R,5S)-1-(5-butoxypentyl)-2-(hydroxymethyl)piperidine-3,4,5-triol
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| Structure |
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| Formula |
C15H31NO5
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| Molecular Weight |
305.415
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| Canonical SMILES |
CCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO
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| InChI |
InChI=1S/C15H31NO5/c1-2-3-8-21-9-6-4-5-7-16-10-13(18)15(20)14(19)12(16)11-17/h12-15,17-20H,2-11H2,1H3/t12-,13+,14-,15-/m1/s1
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| InChIKey |
YMYODBBUEFCWGO-LXTVHRRPSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound