15-Hydroxy-6-[5-[5-[5-[4-hydroxy-5-(4-hydroxy-3-methoxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-9,13,18-trimethyl-19,20-dioxapentacyclo[10.7.1.01,10.04,9.013,17]icos-3-en-14-one
| Internal ID | 0db51ff8-b3e2-4a0d-898f-2500288e2588 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbohydrates and carbohydrate conjugates > Oligosaccharides |
| IUPAC Name | 15-hydroxy-6-[5-[5-[5-[4-hydroxy-5-(4-hydroxy-3-methoxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-9,13,18-trimethyl-19,20-dioxapentacyclo[10.7.1.01,10.04,9.013,17]icos-3-en-14-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C55H88O20/c1-25-17-34(56)50(63-12)52(64-25)73-46-27(3)65-42(20-35(46)57)70-47-29(5)67-44(22-38(47)61-10)72-49-30(6)68-45(23-39(49)62-11)71-48-28(4)66-43(21-37(48)60-9)69-32-14-15-53(7)31(18-32)13-16-55-40(53)24-41(75-55)54(8)33(26(2)74-55)19-36(58)51(54)59/h13,25-30,32-50,52,56-58H,14-24H2,1-12H3 |
| InChI Key | JYHMJCKYASMYCW-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C55H88O20 |
| Molecular Weight | 1069.30 g/mol |
| Exact Mass | 1068.58689519 g/mol |
| Topological Polar Surface Area (TPSA) | 225.00 Ų |
| XlogP | 3.20 |
| There are no found synonyms. |
![2D Structure of 15-Hydroxy-6-[5-[5-[5-[4-hydroxy-5-(4-hydroxy-3-methoxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-9,13,18-trimethyl-19,20-dioxapentacyclo[10.7.1.01,10.04,9.013,17]icos-3-en-14-one](https://plantaedb.com/storage/docs/compounds/2023/11/2a48a7c0-854f-11ee-b27e-a925097b3c36.jpg "2D Structure of 15-Hydroxy-6-[5-[5-[5-[4-hydroxy-5-(4-hydroxy-3-methoxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-9,13,18-trimethyl-19,20-dioxapentacyclo[10.7.1.01,10.04,9.013,17]icos-3-en-14-one")
| 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 |
|---|---|---|---|---|
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 98.49% | 85.14% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.04% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.05% | 91.11% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 92.32% | 100.00% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.08% | 98.95% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.94% | 97.09% |
| CHEMBL3713062 | P10646 | Tissue factor pathway inhibitor | 90.57% | 97.33% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 88.97% | 89.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 88.91% | 94.45% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 88.51% | 95.93% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 88.45% | 92.94% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 87.81% | 91.07% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 86.65% | 95.56% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 86.17% | 94.00% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 86.03% | 97.05% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.61% | 99.23% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 84.42% | 97.25% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 83.48% | 97.14% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.24% | 95.89% |
| CHEMBL1914 | P06276 | Butyrylcholinesterase | 82.22% | 95.00% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 82.11% | 100.00% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 80.84% | 92.62% |
| CHEMBL4072 | P07858 | Cathepsin B | 80.52% | 93.67% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 80.20% | 86.33% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 80.18% | 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.
| Asclepias tuberosa |
| PubChem | 162929637 |
| LOTUS | LTS0100943 |
| wikiData | Q105137020 |