| Collection |
D4 : TTD |
| Chemical Name |
methyl3beta-hydroxyolean-12-en-27-oate ( From PubChem : C H E M B L 2 0 7 4 9 4 ) |
| 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 |
| 470.727 g/mol |
1 |
3 |
7.322 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 1 H 5 0 O 3 / c 1 - 2 6 ( 2 ) 1 5 - 1 6 - 2 8 ( 5 ) 1 7 - 1 8 - 3 1 ( 2 5 ( 3 3 ) 3 4 - 8 ) 2 0 ( 2 1 ( 2 8 ) 1 9 - 2 6 ) 9 - 1 0 - 2 3 - 2 9 ( 6 ) 1 3 - 1 2 - 2 4 ( 3 2 ) 2 7 ( 3 , 4 ) 2 2 ( 2 9 ) 1 1 - 1 4 - 3 0 ( 2 3 , 3 1 ) 7 / h 9 , 2 1 - 2 4 , 3 2 H , 1 0 - 1 9 H 2 , 1 - 8 H 3 / t 2 1 - , 2 2 + , 2 3 + , 2 4 - , 2 8 + , 2 9 - , 3 0 + , 3 1 + / m 0 / s 1 |
| InChIKey |
H E D Y W H F M T A M I I X - J Y U M R K D W S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | PTPN1 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
