Tangeretin
| Internal ID | b8ce64eb-da4a-4e7d-9c1c-af02ded22410 |
| Taxonomy | Phenylpropanoids and polyketides > Flavonoids > O-methylated flavonoids > 8-O-methylated flavonoids |
| IUPAC Name | 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)chromen-4-one |
| SMILES (Canonical) | COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC |
| SMILES (Isomeric) | COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC |
| InChI | InChI=1S/C20H20O7/c1-22-12-8-6-11(7-9-12)14-10-13(21)15-16(23-2)18(24-3)20(26-5)19(25-4)17(15)27-14/h6-10H,1-5H3 |
| InChI Key | ULSUXBXHSYSGDT-UHFFFAOYSA-N |
| Popularity | 745 references in papers |
| Molecular Formula | C20H20O7 |
| Molecular Weight | 372.40 g/mol |
| Exact Mass | 372.12090297 g/mol |
| Topological Polar Surface Area (TPSA) | 72.40 Ų |
| XlogP | 3.00 |
| 481-53-8 |
| Tangeritin |
| Ponkanetin |
| Pentamethoxyflavone |
| 4',5,6,7,8-Pentamethoxyflavone |
| 5,6,7,8,4'-Pentamethoxyflavone |
| 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)chromen-4-one |
| 4H-1-Benzopyran-4-one, 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)- |
| 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one |
| NSC 53909 |
| There are more than 10 synonyms. If you wish to see them all click here. |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| CHEMBL3577 | P00352 | Aldehyde dehydrogenase 1A1 |
1412.5 nM |
Potency |
via CMAUP
|
| CHEMBL5393 | Q9UNQ0 | ATP-binding cassette sub-family G member 2 |
17000 nM 19000 nM |
IC50 IC50 |
PMID: 21354800
PMID: 21354800 |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 |
12589.3 nM 12589.3 nM |
Potency Potency |
via CMAUP
via CMAUP |
| CHEMBL4302 | P08183 | P-glycoprotein 1 |
39000 nM |
IC50 |
PMID: 21354800
|
| CHEMBL1947 | P10828 | Thyroid hormone receptor beta-1 |
0.6 nM 0.6 nM |
Potency Potency |
via Super-PRED
via CMAUP |
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 96.43% | 94.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.21% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.11% | 95.56% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 91.86% | 93.31% |
| CHEMBL2581 | P07339 | Cathepsin D | 90.62% | 98.95% |
| CHEMBL1293294 | P51151 | Ras-related protein Rab-9A | 89.74% | 87.67% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 89.34% | 86.33% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 89.14% | 99.15% |
| CHEMBL1293277 | O15118 | Niemann-Pick C1 protein | 86.96% | 81.11% |
| CHEMBL4016 | P42262 | Glutamate receptor ionotropic, AMPA 2 | 86.05% | 86.92% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.95% | 85.14% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.10% | 94.73% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 85.08% | 85.30% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 84.11% | 93.99% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 82.39% | 90.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 82.24% | 94.45% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 81.13% | 89.00% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 80.05% | 99.17% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| PubChem | 68077 |
| NPASS | NPC40818 |
| ChEMBL | CHEMBL73930 |
| LOTUS | LTS0134301 |
| wikiData | Q1748737 |