General Information of the Compound
| Compound ID |
CP0845452
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| Compound Name |
8-shogaol
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| Structure |
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| Formula |
C19H28O3
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| Molecular Weight |
304.43
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| Canonical SMILES |
CCCCCCC/C=C/C(=O)CCc1ccc(O)c(OC)c1
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| InChI |
InChI=1S/C19H28O3/c1-3-4-5-6-7-8-9-10-17(20)13-11-16-12-14-18(21)19(15-16)22-2/h9-10,12,14-15,21H,3-8,11,13H2,1-2H3/b10-9+
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| InChIKey |
LGZSMXJRMTYABD-MDZDMXLPSA-N
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| CAS |
36700-45-5
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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