General Information of the Compound
| Compound ID |
CP0526262
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| Compound Name |
methyl 5,5-bis(4-hydroxyphenyl)-2-methyl-4-phenylpent-4-enoate
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| Structure |
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| Formula |
C25H24O4
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| Molecular Weight |
388.463
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| Canonical SMILES |
COC(=O)C(C)CC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
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| InChI |
InChI=1S/C25H24O4/c1-17(25(28)29-2)16-23(18-6-4-3-5-7-18)24(19-8-12-21(26)13-9-19)20-10-14-22(27)15-11-20/h3-15,17,26-27H,16H2,1-2H3
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| InChIKey |
AVIAFRILYRGIDG-UHFFFAOYSA-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
Protein ID: PT03765, Estrogen-related receptor gamma
Protein ID: PT02640, Steroid hormone receptor ERR2