Gene Set: D4 : CTD - lupane
| Collection |
D4 : CTD |
| Chemical Name |
lupane ( From PubChem : L U P A 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 |
| 412.734 g/mol |
0 |
0 |
9.1339 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 0 H 5 2 / c 1 - 2 0 ( 2 ) 2 1 - 1 2 - 1 6 - 2 7 ( 5 ) 1 8 - 1 9 - 2 9 ( 7 ) 2 2 ( 2 5 ( 2 1 ) 2 7 ) 1 0 - 1 1 - 2 4 - 2 8 ( 6 ) 1 5 - 9 - 1 4 - 2 6 ( 3 , 4 ) 2 3 ( 2 8 ) 1 3 - 1 7 - 3 0 ( 2 4 , 2 9 ) 8 / h 2 0 - 2 5 H , 9 - 1 9 H 2 , 1 - 8 H 3 / t 2 1 - , 2 2 + , 2 3 + , 2 4 - , 2 5 + , 2 7 - , 2 8 + , 2 9 - , 3 0 - / m 1 / s 1 |
| InChIKey |
N K M D I W K R K Q F Y P H - V C K N Q S F B S A - N
|
| Links |
|
Gene
(7 /
9)
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|
|
| Download gene sets |
gmt, text, Detailed text
|
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Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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