Cuhuoside
Internal ID | b6123ba4-ee20-43e7-9ce3-ea2127953706 |
Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Flavonoid glycosides > Flavonoid O-glycosides > Flavonoid-7-O-glycosides |
IUPAC Name | 7-[(2S,4R,5S)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromen-4-one |
SMILES (Canonical) | CC(=CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)OC)O)OC4C(C(C(C(O4)CO)OC5C(C(C(C(O5)CO)O)O)O)O)O)C |
SMILES (Isomeric) | CC(=CCC1=C(C=C(C2=C1OC(=C(C2=O)O)C3=CC=C(C=C3)OC)O)O[C@H]4C([C@H]([C@@H](C(O4)CO)O[C@H]5C([C@H]([C@@H](C(O5)CO)O)O)O)O)O)C |
InChI | InChI=1S/C33H40O16/c1-13(2)4-9-16-18(10-17(36)21-23(38)25(40)29(48-30(16)21)14-5-7-15(44-3)8-6-14)45-32-28(43)26(41)31(20(12-35)47-32)49-33-27(42)24(39)22(37)19(11-34)46-33/h4-8,10,19-20,22,24,26-28,31-37,39-43H,9,11-12H2,1-3H3/t19?,20?,22-,24+,26-,27?,28?,31-,32-,33+/m1/s1 |
InChI Key | NKVYGZFNIPERMA-RAOGNHHNSA-N |
Popularity | 0 references in papers |
Molecular Formula | C33H40O16 |
Molecular Weight | 692.70 g/mol |
Exact Mass | 692.23163518 g/mol |
Topological Polar Surface Area (TPSA) | 255.00 Ų |
XlogP | 0.80 |
8-Prenylkaempferol 4'-methyl ether 7-cellobioside |
LMPK12112010 |
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 | 99.89% | 91.11% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 96.90% | 94.00% |
CHEMBL2581 | P07339 | Cathepsin D | 94.76% | 98.95% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 94.33% | 89.00% |
CHEMBL3401 | O75469 | Pregnane X receptor | 94.33% | 94.73% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.05% | 94.45% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 92.29% | 99.17% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.13% | 95.56% |
CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 91.62% | 99.15% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.19% | 86.33% |
CHEMBL4016 | P42262 | Glutamate receptor ionotropic, AMPA 2 | 91.01% | 86.92% |
CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 89.91% | 96.00% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 88.62% | 95.89% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 88.60% | 91.49% |
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 87.66% | 85.14% |
CHEMBL1293255 | P15428 | 15-hydroxyprostaglandin dehydrogenase [NAD+] | 87.08% | 83.57% |
CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 83.41% | 95.50% |
CHEMBL4208 | P20618 | Proteasome component C5 | 81.68% | 90.00% |
CHEMBL241 | Q14432 | Phosphodiesterase 3A | 80.13% | 92.94% |
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.
Epimedium acuminatum |
PubChem | 44259061 |
LOTUS | LTS0109957 |
wikiData | Q105181193 |