General Information of the Compound
| Compound ID |
CP0384685
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| Compound Name |
[[(2R,3S,4R,5R)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyridin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl]methylphosphonic acid
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| Structure |
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| Formula |
C11H17NO11P2
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| Molecular Weight |
401.201
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| Canonical SMILES |
O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)CP(O)(O)=O)n1ccc(O)cc1=O
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| InChI |
InChI=1S/C11H17NO11P2/c13-6-1-2-12(8(14)3-6)11-10(16)9(15)7(23-11)4-22-25(20,21)5-24(17,18)19/h1-3,7,9-11,13,15-16H,4-5H2,(H,20,21)(H2,17,18,19)/t7-,9-,10-,11-/m1/s1
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| InChIKey |
YNCOOFKWZGAQLG-QCNRFFRDSA-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