General Information of the Compound
| Compound ID |
CP0868226
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| Compound Name |
Uridine 5'-Glucose-1'-alpha,beta-methylenetriphosphate Triethylammonium salt
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| Structure |
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| Formula |
C22H42N3O19P3
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| Molecular Weight |
745.502
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| Canonical SMILES |
CCN(CC)CC.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)CP(=O)(O)OP(=O)(O)O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H]2O)c(=O)[nH]1
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| InChI |
InChI=1S/C16H27N2O19P3.C6H15N/c19-3-6-9(21)11(23)13(25)15(35-6)36-40(31,32)37-39(29,30)5-38(27,28)33-4-7-10(22)12(24)14(34-7)18-2-1-8(20)17-16(18)26;1-4-7(5-2)6-3/h1-2,6-7,9-15,19,21-25H,3-5H2,(H,27,28)(H,29,30)(H,31,32)(H,17,20,26);4-6H2,1-3H3/t6-,7-,9-,10-,11+,12-,13-,14-,15-;/m1./s1
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| InChIKey |
DTSFQIFRPUYTME-WTCMLTMYSA-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