General Information of the Compound
| Compound ID |
CP0404150
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| Compound Name |
7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-((R)-3-hydroxy-5-p-tolyl-pentyl)-cyclopentyl]-heptanoic acid
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| Structure |
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| Formula |
C24H38O5
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| Molecular Weight |
406.563
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| Canonical SMILES |
Cc1ccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(O)=O)cc1
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| InChI |
InChI=1S/C24H38O5/c1-17-8-10-18(11-9-17)12-13-19(25)14-15-21-20(22(26)16-23(21)27)6-4-2-3-5-7-24(28)29/h8-11,19-23,25-27H,2-7,12-16H2,1H3,(H,28,29)/t19-,20+,21+,22-,23+/m0/s1
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| InChIKey |
MPWQKOQJCWHXTK-BVAFDOMYSA-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