General Information of the Compound
| Compound ID |
CP0454964
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| Compound Name |
6-((1S,5R)-5-heptyl-4-oxocyclopent-2-enyloxy)hexanoic acid
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| Structure |
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| Formula |
C18H30O4
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| Molecular Weight |
310.434
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| Canonical SMILES |
CCCCCCC[C@@H]1[C@@H](OCCCCCC(O)=O)C=CC1=O
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| InChI |
InChI=1S/C18H30O4/c1-2-3-4-5-7-10-15-16(19)12-13-17(15)22-14-9-6-8-11-18(20)21/h12-13,15,17H,2-11,14H2,1H3,(H,20,21)/t15-,17-/m0/s1
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| InChIKey |
UWQUWWRSQDPSOK-RDJZCZTQSA-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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00909, Peroxisome proliferator-activated receptor delta
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma