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Basic Description
| Synonyms | THYMOLPHTHALEIN|125-20-2|Thymophthalein|MLS000736489|TCMDC-123951|NSC2186|NSC-2186|MFCD00005909|YG5I28WSQP|3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one|5',5''-Diisopropyl-2',2''-dimethylphenolphthalein|SMR000528039|Phenolphthalein, 5 |
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| Specifications & Purity | 0.05% |
| Shipped In | Normal |
Associated Targets
CYP1A2 Tchem Cytochrome P450 1A2 0 Activities
CYP2D6 Tclin Cytochrome P450 2D6 0 Activities
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CYP2C19 Tchem Cytochrome P450 2C19 0 Activities
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CYP3A4 Tclin Cytochrome P450 3A4 0 Activities
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CYP2C9 Tchem Cytochrome P450 2C9 1 Activities
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GMNN Tbio Geminin 0 Activities
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RORC Tchem Nuclear receptor ROR-gamma 0 Activities
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HIF1A Tchem Hypoxia-inducible factor 1-alpha 0 Activities
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SMAD3 Tchem Mothers against decapentaplegic homolog 3 0 Activities
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LMNA Tbio Prelamin-A/C 0 Activities
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ALOX15B Tchem Arachidonate 15-lipoxygenase B 0 Activities
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ALOX15 Tchem Arachidonate 15-lipoxygenase 0 Activities
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MC4R Tclin Melanocortin receptor 4 0 Activities
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BRCA1 Tchem Breast cancer type 1 susceptibility protein 0 Activities
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BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B 0 Activities
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ATXN2 Tbio Ataxin-2 0 Activities
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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 0 Activities
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ADRB2 Tclin Beta-2 adrenergic receptor 0 Activities
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APOBEC3F Tbio DNA dC->dU-editing enzyme APOBEC-3F 0 Activities
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GNAS Tbio Protein ALEX 0 Activities
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MAPT Tclin Microtubule-associated protein tau 0 Activities
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ATAD5 Tbio ATPase family AAA domain-containing protein 5 0 Activities
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SLC2A1 Tchem Solute carrier family 2, facilitated glucose transporter member 1 0 Activities
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KPNB1 Tbio Importin subunit beta-1 0 Activities
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GLP1R Tclin Glucagon-like peptide 1 receptor 0 Activities
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IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic 0 Activities
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PAX8 Tchem Paired box protein Pax-8 0 Activities
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TP53 Tchem Cellular tumor antigen p53 0 Activities
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NFE2L2 Tchem Nuclear factor erythroid 2-related factor 2 0 Activities
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NPSR1 Tchem Neuropeptide S receptor 0 Activities
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Names and Identifiers
| IUPAC Name | 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one |
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| INCHI | InChI=1S/C28H30O4/c1-15(2)20-13-23(17(5)11-25(20)29)28(22-10-8-7-9-19(22)27(31)32-28)24-14-21(16(3)4)26(30)12-18(24)6/h7-16,29-30H,1-6H3 |
| InChi Key | LDKDGDIWEUUXSH-UHFFFAOYSA-N |
| Canonical SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
| Isomeric SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
| WGK Germany | 3 |
| PubChem CID | 31316 |
| Molecular Weight | 430.54 |
| Beilstein | 359413 |
| Reaxy-Rn | 359413 |
Certificates
Certificate of Analysis(COA)
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Chemical and Physical Properties
| Melt Point(°C) | 251-253°C |
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Safety and Hazards(GHS)
| WGK Germany | 3 |
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| Reaxy-Rn | 359413 |
| Merck Index | 9401 |