Macrosporin 2-O-(6'-acetyl)-a-d-glucopyranoside
| Internal ID | e9b038db-778a-42ef-b8ec-d93f63044977 |
| Taxonomy | Benzenoids > Anthracenes > Anthraquinones |
| IUPAC Name | [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(8-hydroxy-6-methoxy-3-methyl-9,10-dioxoanthracen-2-yl)oxyoxan-2-yl]methyl acetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H24O11/c1-9-4-12-13(20(28)18-14(19(12)27)5-11(32-3)6-15(18)26)7-16(9)34-24-23(31)22(30)21(29)17(35-24)8-33-10(2)25/h4-7,17,21-24,26,29-31H,8H2,1-3H3/t17-,21-,22+,23-,24+/m1/s1 |
| InChI Key | SIAFXYFDIILGJD-JCTDHXFVSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C24H24O11 |
| Molecular Weight | 488.40 g/mol |
| Exact Mass | 488.13186158 g/mol |
| Topological Polar Surface Area (TPSA) | 169.00 Ų |
| XlogP | 1.30 |
| Macrosporin 2-O-(6'-acetyl)-a-d-glucopyranoside |
| 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 | 98.07% | 91.11% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 97.70% | 85.14% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.96% | 96.09% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 95.22% | 89.00% |
| CHEMBL2581 | P07339 | Cathepsin D | 93.96% | 98.95% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.84% | 95.56% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 93.73% | 99.15% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 93.27% | 99.23% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 93.04% | 94.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 91.50% | 94.73% |
| CHEMBL3714130 | P46095 | G-protein coupled receptor 6 | 91.43% | 97.36% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 91.13% | 95.93% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 90.25% | 99.17% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 88.08% | 91.49% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 87.96% | 96.21% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 86.98% | 90.00% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 86.48% | 96.95% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 85.99% | 97.21% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.07% | 86.33% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 83.95% | 92.50% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 83.57% | 96.77% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 83.45% | 96.00% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 81.07% | 91.19% |
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.
| There are no matching plants. |
| PubChem | 139587782 |
| LOTUS | LTS0131489 |
| wikiData | Q77573900 |