Tanshindiol C
Internal ID | 14be7d89-b637-4d5c-a8a6-bcc8b4f4b820 |
Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Tanshinones, isotanshinones, and derivatives |
IUPAC Name | (6R,7R)-6,7-dihydroxy-1,6-dimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione |
SMILES (Canonical) | CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CCC(C4(C)O)O |
SMILES (Isomeric) | CC1=COC2=C1C(=O)C(=O)C3=C2C=CC4=C3CC[C@H]([C@]4(C)O)O |
InChI | InChI=1S/C18H16O5/c1-8-7-23-17-10-3-5-11-9(4-6-12(19)18(11,2)22)14(10)16(21)15(20)13(8)17/h3,5,7,12,19,22H,4,6H2,1-2H3/t12-,18-/m1/s1 |
InChI Key | RTKDBIDPGKCZJS-KZULUSFZSA-N |
Popularity | 4 references in papers |
Molecular Formula | C18H16O5 |
Molecular Weight | 312.30 g/mol |
Exact Mass | 312.09977361 g/mol |
Topological Polar Surface Area (TPSA) | 87.70 Ų |
XlogP | 1.20 |
97465-71-9 |
Przewaquinone D |
Przewaquinone E |
96839-30-4 |
CHEMBL3287734 |
(6R,7R)-6,7-dihydroxy-1,6-dimethyl-8,9-dihydro-7H-naphtho[1,2-g][1]benzofuran-10,11-dione |
Phenanthro[1,2-b]furan-10,11-dione, 6,7,8,9-tetrahydro-6,7-dihydroxy-1,6-dimethyl-, (6R,7R)-(-)- |
SCHEMBL14417695 |
DTXSID30914287 |
BDBM50017292 |
There are more than 10 synonyms. If you wish to see them all click here. |
Target | Value | Probability (raw) | Probability (%) |
---|---|---|---|
No predicted properties yet! |
Proven Targets:
CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
---|---|---|---|---|---|
CHEMBL3137286 | Q15910 | EZH2/SUZ12/EED complex |
550 nM 520 nM |
IC50 IC50 |
via Super-PRED
via Super-PRED |
CHEMBL3301388 | Q15910 | EZH2/SUZ12/EED/RBBP7/RBBP4 |
194 nM |
Ki |
via Super-PRED
|
Predicted Targets (via Super-PRED):
CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
---|---|---|---|---|
CHEMBL2581 | P07339 | Cathepsin D | 97.20% | 98.95% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.45% | 91.11% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.98% | 95.56% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 93.70% | 89.00% |
CHEMBL1994 | P08235 | Mineralocorticoid receptor | 90.32% | 100.00% |
CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 90.19% | 96.38% |
CHEMBL3137262 | O60341 | LSD1/CoREST complex | 88.51% | 97.09% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 86.76% | 99.23% |
CHEMBL340 | P08684 | Cytochrome P450 3A4 | 86.32% | 91.19% |
CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 84.89% | 93.04% |
CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 83.82% | 96.67% |
CHEMBL1871 | P10275 | Androgen Receptor | 82.89% | 96.43% |
CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 81.95% | 96.21% |
CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 81.27% | 85.11% |
CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.45% | 95.89% |
CHEMBL5028 | O14672 | ADAM10 | 80.30% | 97.50% |
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.
PubChem | 126072 |
NPASS | NPC10051 |
ChEMBL | CHEMBL3287734 |
LOTUS | LTS0043464 |
wikiData | Q82885062 |