General Information of the Compound
| Compound ID |
CP0363266
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| Compound Name |
(2E,4E,6Z,8E)-3,7-dimethyl-8-(3-phenyl-2-propan-2-ylcyclohex-2-en-1-ylidene)octa-2,4,6-trienoic acid
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| Structure |
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| Formula |
C25H30O2
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| Molecular Weight |
362.513
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| Canonical SMILES |
CC(C)C1=C(CCC\C1=C/C(/C)=C\C=C\C(\C)=C\C(O)=O)c1ccccc1
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| InChI |
InChI=1S/C25H30O2/c1-18(2)25-22(14-9-15-23(25)21-12-6-5-7-13-21)16-19(3)10-8-11-20(4)17-24(26)27/h5-8,10-13,16-18H,9,14-15H2,1-4H3,(H,26,27)/b11-8+,19-10-,20-17+,22-16+
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| InChIKey |
OGPCAFPMTHWNOM-NUXCVKLASA-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