General Information of the Compound
| Compound ID |
CP0150432
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| Compound Name |
5-Bromo-4-methoxy-2-[(E)-3-(4,6,6-trimethyl-2-methylene-cyclohex-3-enyl)-propenyl]-phenol
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| Structure |
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| Formula |
C20H25BrO2
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| Molecular Weight |
377.322
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| Canonical SMILES |
COc1cc(\C=C\CC2C(=C)C=C(C)CC2(C)C)c(O)cc1Br
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| InChI |
InChI=1S/C20H25BrO2/c1-13-9-14(2)16(20(3,4)12-13)8-6-7-15-10-19(23-5)17(21)11-18(15)22/h6-7,9-11,16,22H,2,8,12H2,1,3-5H3/b7-6+
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| InChIKey |
HBEGIVRBESAQLK-VOTSOKGWSA-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