General Information of the Compound
| Compound ID |
CP0866768
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| Compound Name |
7-((1R,2S,3R)-3-hydroxy-2-(4-(1-hydroxy-2-methylpropan-2-yl)phenyl)-5-oxocyclopentyl)heptanoic acid
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| Structure |
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| Formula |
C22H32O5
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| Molecular Weight |
376.493
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| Canonical SMILES |
CC(C)(CO)c1ccc([C@H]2[C@H](O)CC(=O)[C@@H]2CCCCCCC(=O)O)cc1
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| InChI |
InChI=1S/C22H32O5/c1-22(2,14-23)16-11-9-15(10-12-16)21-17(18(24)13-19(21)25)7-5-3-4-6-8-20(26)27/h9-12,17,19,21,23,25H,3-8,13-14H2,1-2H3,(H,26,27)/t17-,19+,21+/m0/s1
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| InChIKey |
HNJALCPDBOOKTH-FBBABVLZSA-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