General Information of the Compound
| Compound ID |
CP0392639
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| Compound Name |
1-(1,3-benzodioxol-5-yl)-5-hydroxy-11-phenylundecan-3-one
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| Structure |
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| Formula |
C24H30O4
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| Molecular Weight |
382.5
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| Canonical SMILES |
OC(CCCCCCc1ccccc1)CC(=O)CCc1ccc2OCOc2c1
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| InChI |
InChI=1S/C24H30O4/c25-21(11-7-2-1-4-8-19-9-5-3-6-10-19)17-22(26)14-12-20-13-15-23-24(16-20)28-18-27-23/h3,5-6,9-10,13,15-16,21,25H,1-2,4,7-8,11-12,14,17-18H2
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| InChIKey |
SRIXRPCMEOZYEY-UHFFFAOYSA-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: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1