Gene Set: D4 : CTD - methyllycaconitine
| Collection |
D4 : CTD |
| Chemical Name |
methyllycaconitine ( From PubChem : D E L S E M 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 |
| 682.8 g/mol |
2 |
12 |
2.038 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 7 H 5 0 N 2 O 1 0 / c 1 - 7 - 3 8 - 1 7 - 3 4 ( 1 8 - 4 9 - 3 2 ( 4 2 ) 2 0 - 1 0 - 8 - 9 - 1 1 - 2 3 ( 2 0 ) 3 9 - 2 6 ( 4 0 ) 1 4 - 1 9 ( 2 ) 3 1 ( 3 9 ) 4 1 ) 1 3 - 1 2 - 2 5 ( 4 6 - 4 ) 3 6 - 2 2 - 1 5 - 2 1 - 2 4 ( 4 5 - 3 ) 1 6 - 3 5 ( 4 3 , 2 7 ( 2 2 ) 2 8 ( 2 1 ) 4 7 - 5 ) 3 7 ( 4 4 , 3 3 ( 3 6 ) 3 8 ) 3 0 ( 4 8 - 6 ) 2 9 ( 3 4 ) 3 6 / h 8 - 1 1 , 1 9 , 2 1 - 2 2 , 2 4 - 2 5 , 2 7 - 3 0 , 3 3 , 4 3 - 4 4 H , 7 , 1 2 - 1 8 H 2 , 1 - 6 H 3 / t 1 9 - , 2 1 + , 2 2 + , 2 4 - , 2 5 - , 2 7 + , 2 8 - , 2 9 + , 3 0 - , 3 3 - , 3 4 - , 3 5 + , 3 6 - , 3 7 + / m 0 / s 1 |
| InChIKey |
X L T A N A W L D B Y G F U - V T L K B Q Q I S A - N
|
| Links |
|
Gene
(17 /
86)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
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