Gene Set: D4 : CTD - Reserpine
| Collection |
D4 : CTD |
| Chemical Name |
Reserpine ( From PubChem : R E S E R P I N E ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Approved | Not | Approved | Approved | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 608.679 g/mol |
1 |
10 |
4.109 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 3 H 4 0 N 2 O 9 / c 1 - 3 8 - 1 9 - 7 - 8 - 2 0 - 2 1 - 9 - 1 0 - 3 5 - 1 6 - 1 8 - 1 3 - 2 7 ( 4 4 - 3 2 ( 3 6 ) 1 7 - 1 1 - 2 5 ( 3 9 - 2 ) 3 0 ( 4 1 - 4 ) 2 6 ( 1 2 - 1 7 ) 4 0 - 3 ) 3 1 ( 4 2 - 5 ) 2 8 ( 3 3 ( 3 7 ) 4 3 - 6 ) 2 2 ( 1 8 ) 1 5 - 2 4 ( 3 5 ) 2 9 ( 2 1 ) 3 4 - 2 3 ( 2 0 ) 1 4 - 1 9 / h 7 - 8 , 1 1 - 1 2 , 1 4 , 1 8 , 2 2 , 2 4 , 2 7 - 2 8 , 3 1 , 3 4 H , 9 - 1 0 , 1 3 , 1 5 - 1 6 H 2 , 1 - 6 H 3 / t 1 8 - , 2 2 + , 2 4 - , 2 7 - , 2 8 + , 3 1 + / m 1 / s 1 |
| InChIKey |
Q E V H R U U C F G R F I F - M D E J G Z G S S A - N
|
| Links |
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Gene
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96)
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12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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