Pyramidatin H
| Internal ID | cfd152a0-2a4a-4053-96b7-2a45c209517c |
| Taxonomy | Phenylpropanoids and polyketides > Tannins > Hydrolyzable tannins |
| IUPAC Name | (1R,21R,24R)-9,12-dimethoxy-24-methyl-5,7,14,16,23-pentaoxahexacyclo[19.2.1.02,10.04,8.011,19.013,17]tetracosa-2,4(8),9,11,13(17),18-hexaene |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C22H22O7/c1-10-12-4-11-5-14-19(28-8-26-14)21(23-2)16(11)17-13(18(10)25-7-12)6-15-20(22(17)24-3)29-9-27-15/h5-6,10,12,18H,4,7-9H2,1-3H3/t10-,12+,18-/m1/s1 |
| InChI Key | ZXZUDTYLUHGDRO-GDAOTKPNSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C22H22O7 |
| Molecular Weight | 398.40 g/mol |
| Exact Mass | 398.13655304 g/mol |
| Topological Polar Surface Area (TPSA) | 64.60 Ų |
| XlogP | 3.70 |
| 5,7-(epoxymethano)-1,3-benzodioxolo[5',6':3,4]cycloocta[1,2-f][1,3]benzodioxole, 5,6,7,8-tetrahydro-13,14-dimethoxy-6-methyl-, (5R,6R,7R)- |
| InChI=1/C22H22O7/c1-10-12-4-11-5-14-19(28-8-26-14)21(23-2)16(11)17-13(18(10)25-7-12)6-15-20(22(17)24-3)29-9-27-15/h5-6,10,12,18H,4,7-9H2,1-3H3/t10-,12+,18-/m1/s |
| rel-(1R,21R,24R)-9,12-dimethoxy-24-methyl-5,7,14,16,23-pentaoxahexacyclo[19.2.1.0~2,10~.0~4,8~.0~11,19~.0~13,17~]tetracosa-2(10),3,8,11(19),12,17-hexaene (non-preferred name) |
| 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 | 95.81% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.78% | 96.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 92.97% | 86.33% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 91.54% | 96.77% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 90.25% | 93.40% |
| CHEMBL2581 | P07339 | Cathepsin D | 88.32% | 98.95% |
| CHEMBL261 | P00915 | Carbonic anhydrase I | 86.97% | 96.76% |
| CHEMBL4225 | P49760 | Dual specificity protein kinase CLK2 | 86.64% | 80.96% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 86.31% | 92.62% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 86.16% | 93.99% |
| CHEMBL5311 | P37023 | Serine/threonine-protein kinase receptor R3 | 85.24% | 82.67% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 83.59% | 95.56% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 83.02% | 97.14% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 82.39% | 94.45% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 82.17% | 97.25% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 81.93% | 97.09% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 80.19% | 89.00% |
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 | 637214 |
| LOTUS | LTS0064782 |
| wikiData | Q105385949 |