| Collection |
D4 : TTD |
| Chemical Name |
ACTINOPLANIC ACID A ( From PubChem : A C T I N O P L A N I C A C I D A ) |
| 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 |
| 949.171 g/mol |
5 |
16 |
8.7647 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 1 H 8 0 O 1 6 / c 1 - 9 - 3 9 ( 2 5 - 3 6 ( 7 ) 4 9 ( 5 9 ) 6 0 ) 4 3 ( 5 2 ) 2 1 - 1 9 - 3 8 - 2 4 - 3 3 ( 4 ) 2 2 - 3 2 ( 3 ) 2 3 - 3 5 ( 6 ) 4 8 ( 5 8 ) 3 4 ( 5 ) 1 7 - 2 0 - 4 2 ( 6 7 - 4 7 ( 5 7 ) 2 9 - 4 1 ( 5 1 ( 6 3 ) 6 4 ) 2 7 - 4 5 ( 5 5 ) 6 5 - 3 0 - 3 8 ) 1 5 - 1 3 - 1 1 - 1 0 - 1 2 - 1 4 - 3 1 ( 2 ) 1 6 - 1 8 - 3 7 ( 8 ) 6 6 - 4 6 ( 5 6 ) 2 8 - 4 0 ( 5 0 ( 6 1 ) 6 2 ) 2 6 - 4 4 ( 5 3 ) 5 4 / h 1 2 , 1 4 , 2 3 - 2 4 , 3 1 , 3 3 - 3 7 , 3 9 - 4 2 , 4 8 , 5 8 H , 9 - 1 1 , 1 3 , 1 5 - 2 2 , 2 5 - 3 0 H 2 , 1 - 8 H 3 , ( H , 5 3 , 5 4 ) ( H , 5 9 , 6 0 ) ( H , 6 1 , 6 2 ) ( H , 6 3 , 6 4 ) / b 1 4 - 1 2 + , 3 2 - 2 3 + , 3 8 - 2 4 - |
| InChIKey |
Z J C P E I G Q Y K M Z F E - P X Q K R T I O S A - N
|
| Links |
|
Gene
(3 /
4)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CH17-360D5.1 | | | Discontinued target | | TTD | Inhibitor | FNTA | | | Discontinued target | | TTD | Inhibitor | FNTB | | | Research target | | TTD | Inhibitor | FNTB | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
