General Information of the Compound
| Compound ID |
CP0935327
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| Compound Name |
(S)-17-Hydroxy-docosa-7,10,13,15-tetraenoic acid (17(S)-OH-22 : 4)
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| Structure |
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| Formula |
C22H36O3
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| Molecular Weight |
348.527
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| Canonical SMILES |
CCCCC[C@H](O)/C=C/C=C\C/C=C\C/C=C\CCCCCC(=O)O
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| InChI |
InChI=1S/C22H36O3/c1-2-3-15-18-21(23)19-16-13-11-9-7-5-4-6-8-10-12-14-17-20-22(24)25/h5-8,11,13,16,19,21,23H,2-4,9-10,12,14-15,17-18,20H2,1H3,(H,24,25)/b7-5-,8-6-,13-11-,19-16+/t21-/m0/s1
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| InChIKey |
JALSVOZEVSMDLQ-IZCUWNJCSA-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