| Collection |
D4 : CTD |
| Chemical Name |
tomatidine ( From PubChem : T O M A T I D I N E ) |
| 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 |
| 415.652 g/mol |
2 |
3 |
5.6956 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 4 5 N O 2 / c 1 - 1 6 - 7 - 1 2 - 2 7 ( 2 8 - 1 5 - 1 6 ) 1 7 ( 2 ) 2 4 - 2 3 ( 3 0 - 2 7 ) 1 4 - 2 2 - 2 0 - 6 - 5 - 1 8 - 1 3 - 1 9 ( 2 9 ) 8 - 1 0 - 2 5 ( 1 8 , 3 ) 2 1 ( 2 0 ) 9 - 1 1 - 2 6 ( 2 2 , 2 4 ) 4 / h 1 6 - 2 4 , 2 8 - 2 9 H , 5 - 1 5 H 2 , 1 - 4 H 3 / t 1 6 - , 1 7 - , 1 8 - , 1 9 - , 2 0 + , 2 1 - , 2 2 - , 2 3 - , 2 4 - , 2 5 - , 2 6 - , 2 7 - / m 0 / s 1 |
| InChIKey |
X Y N P Y H X G M W J B L V - V X P J T D K G S A - N
|
| Links |
|
Gene
(8 /
8)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
