Apigenin 7-O-beta-glucuronide
Internal ID | 6aa8c6b5-91d1-4386-890e-55778626393f |
Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Flavonoid glycosides > Flavonoid O-glucuronides > Flavonoid-7-O-glucuronides |
IUPAC Name | 3,4,5-trihydroxy-6-[6-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid |
SMILES (Canonical) | C1=CC(=CC=C1C2=CC(=O)C3=CC(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O |
SMILES (Isomeric) | C1=CC(=CC=C1C2=CC(=O)C3=CC(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O |
InChI | InChI=1S/C21H18O11/c22-9-3-1-8(2-4-9)13-6-11(23)10-5-12(24)15(7-14(10)30-13)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-22,24-27H,(H,28,29) |
InChI Key | VIAHYBRXOYNMIB-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C21H18O11 |
Molecular Weight | 446.40 g/mol |
Exact Mass | 446.08491139 g/mol |
Topological Polar Surface Area (TPSA) | 183.00 Ų |
XlogP | 0.60 |
There are no found synonyms. |
![2D Structure of Apigenin 7-O-beta-glucuronide 2D Structure of Apigenin 7-O-beta-glucuronide](https://plantaedb.com/storage/docs/compounds/2023/11/apigenin-7-o-beta-glucuronide.jpg)
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
Proven Targets:
CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
---|---|---|---|---|---|
No proven targets yet! |
Predicted Targets (via Super-PRED):
CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
---|---|---|---|---|
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 98.86% | 91.11% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 97.19% | 89.00% |
CHEMBL3194 | P02766 | Transthyretin | 94.62% | 90.71% |
CHEMBL2581 | P07339 | Cathepsin D | 94.23% | 98.95% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.02% | 95.56% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 90.49% | 94.00% |
CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 90.18% | 99.15% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 88.89% | 91.49% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 88.72% | 99.17% |
CHEMBL1293255 | P15428 | 15-hydroxyprostaglandin dehydrogenase [NAD+] | 88.22% | 83.57% |
CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 86.94% | 91.71% |
CHEMBL5339 | Q5NUL3 | G-protein coupled receptor 120 | 86.30% | 95.78% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 85.22% | 99.23% |
CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 85.17% | 90.71% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 84.82% | 94.45% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.43% | 86.33% |
CHEMBL2345 | P51812 | Ribosomal protein S6 kinase alpha 3 | 84.29% | 95.64% |
CHEMBL4530 | P00488 | Coagulation factor XIII | 82.51% | 96.00% |
CHEMBL5284 | Q96RR4 | CaM-kinase kinase beta | 80.68% | 89.23% |
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.
Lactuca formosana |
PubChem | 74315906 |
LOTUS | LTS0108427 |
wikiData | Q104398970 |