| Collection |
D4 : TTD |
| Chemical Name |
Guttiferone I ( From PubChem : G U T T I F E R O N E I ) |
| 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 |
| 670.917 g/mol |
3 |
6 |
10.6286 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 3 H 5 8 O 6 / c 1 - 2 7 ( 2 ) 1 3 - 1 1 - 1 5 - 3 1 ( 9 ) 1 6 - 1 8 - 3 3 - 2 6 - 4 2 ( 2 3 - 2 0 - 2 9 ( 5 ) 6 ) 3 8 ( 4 7 ) 3 6 ( 3 7 ( 4 6 ) 3 2 - 1 7 - 1 9 - 3 4 ( 4 4 ) 3 5 ( 4 5 ) 2 5 - 3 2 ) 3 9 ( 4 8 ) 4 3 ( 4 0 ( 4 2 ) 4 9 , 2 4 - 2 1 - 3 0 ( 7 ) 8 ) 4 1 ( 3 3 , 1 0 ) 2 2 - 1 2 - 1 4 - 2 8 ( 3 ) 4 / h 1 3 - 1 4 , 1 6 - 1 7 , 1 9 - 2 1 , 2 5 , 3 3 , 4 4 - 4 6 H , 1 1 - 1 2 , 1 5 , 1 8 , 2 2 - 2 4 , 2 6 H 2 , 1 - 1 0 H 3 / b 3 1 - 1 6 + , 3 7 - 3 6 + / t 3 3 - , 4 1 + , 4 2 - , 4 3 + / m 0 / s 1 |
| InChIKey |
H I G O X Q Q R S U D J C L - K J L W U Z B S S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | NR1H3 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
