General Information of the Compound
| Compound ID |
CP0412559
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| Compound Name |
[2-[(3,4-dihydroxyphenyl)methylamino]-2-oxoethyl] (2E)-3,7-dimethylocta-2,6-dienoate
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| Structure |
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| Formula |
C19H25NO5
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| Molecular Weight |
347.411
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| Canonical SMILES |
CC(C)=CCC\C(C)=C\C(=O)OCC(=O)NCc1ccc(O)c(O)c1
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| InChI |
InChI=1S/C19H25NO5/c1-13(2)5-4-6-14(3)9-19(24)25-12-18(23)20-11-15-7-8-16(21)17(22)10-15/h5,7-10,21-22H,4,6,11-12H2,1-3H3,(H,20,23)/b14-9+
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| InChIKey |
TYBKSGRXKAFYHA-NTEUORMPSA-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: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1