General Information of the Compound
| Compound ID |
CP0777024
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| Compound Name |
4-Hydroxy-6-phenethyl-3-(1-phenyl-propyl)-6-propyl-5,6-dihydro-pyran-2-one
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| Formula |
C25H30O3
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| Molecular Weight |
378.512
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| Canonical SMILES |
CCCC1(CCc2ccccc2)CC(=O)C(C(CC)c2ccccc2)=C(O)O1
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| InChI |
InChI=1S/C25H30O3/c1-3-16-25(17-15-19-11-7-5-8-12-19)18-22(26)23(24(27)28-25)21(4-2)20-13-9-6-10-14-20/h5-14,21,27H,3-4,15-18H2,1-2H3
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| InChIKey |
NPJSKDXNSZCWBY-UHFFFAOYSA-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