General Information of the Compound
| Compound ID |
CP0930472
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| Compound Name |
7-((1R,2S)-2-(3-(1-hydroxyhexyl)phenyl)-5-oxocyclopentyl)heptanoic acid
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| Structure |
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| Formula |
C24H36O4
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| Molecular Weight |
388.548
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| Canonical SMILES |
CCCCCC(O)c1cccc([C@H]2CCC(=O)[C@@H]2CCCCCCC(=O)O)c1
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| InChI |
InChI=1S/C24H36O4/c1-2-3-6-13-22(25)19-11-9-10-18(17-19)20-15-16-23(26)21(20)12-7-4-5-8-14-24(27)28/h9-11,17,20-22,25H,2-8,12-16H2,1H3,(H,27,28)/t20-,21-,22?/m1/s1
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| InChIKey |
BLOIHCNTBIMVJG-JAZPPYFYSA-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