General Information of the Compound
| Compound ID |
CP0858815
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| Compound Name |
(E)-6-(3,4-Dimethoxyphenyl)-4-oxohex-5-enoic acid ethanolamide
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| Structure |
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| Formula |
C16H21NO5
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| Molecular Weight |
307.346
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| Canonical SMILES |
COc1ccc(/C=C/C(=O)CCC(=O)NCCO)cc1OC
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| InChI |
InChI=1S/C16H21NO5/c1-21-14-7-4-12(11-15(14)22-2)3-5-13(19)6-8-16(20)17-9-10-18/h3-5,7,11,18H,6,8-10H2,1-2H3,(H,17,20)/b5-3+
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| InChIKey |
SYNHSNBHAZTNRH-HWKANZROSA-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
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2