General Information of the Compound
| Compound ID |
CP0477667
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| Compound Name |
[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4S,5S)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphate
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| Structure |
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| Formula |
C14H22N2O16P2
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| Molecular Weight |
536.276
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| Canonical SMILES |
O[C@H]1O[C@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@@H](O)[C@@H]1O
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| InChI |
InChI=1S/C14H22N2O16P2/c17-7-1-2-16(14(23)15-7)12-10(20)8(18)5(30-12)3-28-33(24,25)32-34(26,27)29-4-6-9(19)11(21)13(22)31-6/h1-2,5-6,8-13,18-22H,3-4H2,(H,24,25)(H,26,27)(H,15,17,23)/t5-,6-,8-,9-,10-,11+,12-,13+/m1/s1
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| InChIKey |
SKYUZXPVTIYYCT-NWBHGABRSA-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