General Information of the Compound
| Compound ID |
CP0375810
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| Compound Name |
7-{(1R,2R,3R,5S)-3,5-Dihydroxy-2-[(R)-3-hydroxy-5-(2-methoxy-phenyl)-pentyl]-cyclopentyl}-heptanoic acid
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| Structure |
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| Formula |
C24H38O6
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| Molecular Weight |
422.562
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| Canonical SMILES |
COc1ccccc1CC[C@H](O)CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(O)=O
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| InChI |
InChI=1S/C24H38O6/c1-30-23-10-7-6-8-17(23)12-13-18(25)14-15-20-19(21(26)16-22(20)27)9-4-2-3-5-11-24(28)29/h6-8,10,18-22,25-27H,2-5,9,11-16H2,1H3,(H,28,29)/t18-,19+,20+,21-,22+/m0/s1
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| InChIKey |
UKMPQZNAHCQQAM-AHJNKEMKSA-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