| Collection |
D4 : TTD |
| Chemical Name |
3r-Hydroxydecanoyl-Coa ( From PubChem : 3 R - H Y D R O X Y D E C A N O Y L - C O E N Z Y M E 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 |
| 937.783 g/mol |
10 |
26 |
2.1392 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 1 H 5 4 N 7 O 1 8 P 3 S / c 1 - 4 - 5 - 6 - 7 - 8 - 9 - 1 9 ( 3 9 ) 1 4 - 2 2 ( 4 1 ) 6 0 - 1 3 - 1 2 - 3 3 - 2 1 ( 4 0 ) 1 0 - 1 1 - 3 4 - 2 9 ( 4 4 ) 2 6 ( 4 3 ) 3 1 ( 2 , 3 ) 1 6 - 5 3 - 5 9 ( 5 0 , 5 1 ) 5 6 - 5 8 ( 4 8 , 4 9 ) 5 2 - 1 5 - 2 0 - 2 5 ( 5 5 - 5 7 ( 4 5 , 4 6 ) 4 7 ) 2 4 ( 4 2 ) 3 0 ( 5 4 - 2 0 ) 3 8 - 1 8 - 3 7 - 2 3 - 2 7 ( 3 2 ) 3 5 - 1 7 - 3 6 - 2 8 ( 2 3 ) 3 8 / h 1 7 - 2 0 , 2 4 - 2 6 , 3 0 , 3 9 , 4 2 - 4 3 H , 4 - 1 6 H 2 , 1 - 3 H 3 , ( H , 3 3 , 4 0 ) ( H , 3 4 , 4 4 ) ( H , 4 8 , 4 9 ) ( H , 5 0 , 5 1 ) ( H 2 , 3 2 , 3 5 , 3 6 ) ( H 2 , 4 5 , 4 6 , 4 7 ) / t 1 9 - , 2 0 - , 2 4 - , 2 5 - , 2 6 + , 3 0 - / m 1 / s 1 |
| InChIKey |
H I V S M Y Z A M U N F K Z - P D Q A C D D G S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | HSD17B4 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
