General Information of the Compound
| Compound ID |
CP0492029
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| Compound Name |
(2E,6E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-3,7,11-trimethyldodeca-2,6,10-trienamide
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| Structure |
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| Formula |
C23H33NO3
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| Molecular Weight |
371.521
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| Canonical SMILES |
COc1cc(CNC(=O)\C=C(/C)CC\C=C(/C)CCC=C(C)C)ccc1O
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| InChI |
InChI=1S/C23H33NO3/c1-17(2)8-6-9-18(3)10-7-11-19(4)14-23(26)24-16-20-12-13-21(25)22(15-20)27-5/h8,10,12-15,25H,6-7,9,11,16H2,1-5H3,(H,24,26)/b18-10+,19-14+
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| InChIKey |
MCXBWGHOXCXUTP-VBYAGUOWSA-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