Gene Set: D4 : TTD - (-)-thujaplicatintrimethyl ether
| Collection |
D4 : TTD |
| Chemical Name |
(-)-thujaplicatintrimethyl ether ( From PubChem : C H E M B L 4 6 9 9 1 7 ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 388.411 g/mol |
2 |
7 |
2.698 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 1 H 2 4 O 7 / c 1 - 2 5 - 1 7 - 8 - 1 2 ( 4 - 5 - 1 6 ( 1 7 ) 2 2 ) 6 - 1 4 - 1 1 - 2 8 - 2 1 ( 2 4 ) 1 5 ( 1 4 ) 7 - 1 3 - 9 - 1 8 ( 2 6 - 2 ) 2 0 ( 2 3 ) 1 9 ( 1 0 - 1 3 ) 2 7 - 3 / h 4 - 5 , 8 - 1 0 , 1 4 - 1 5 , 2 2 - 2 3 H , 6 - 7 , 1 1 H 2 , 1 - 3 H 3 / t 1 4 - , 1 5 + / m 1 / s 1 |
| InChIKey |
X M L W G U K R P G L J G A - C A B C V R R E S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CYP3A4 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
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University of Colorado School of Medicine
Aurora, CO 80045, USA
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