Gene Set: D4 : CTD - tanespimycin
| Collection |
D4 : CTD |
| Chemical Name |
tanespimycin ( From PubChem : T A N E S P I M Y C I N ) |
| 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 |
| 585.688 g/mol |
4 |
11 |
3.9576 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 1 H 4 3 N 3 O 8 / c 1 - 8 - 1 2 - 3 3 - 2 6 - 2 1 - 1 3 - 1 7 ( 2 ) 1 4 - 2 5 ( 4 1 - 7 ) 2 7 ( 3 6 ) 1 9 ( 4 ) 1 5 - 2 0 ( 5 ) 2 9 ( 4 2 - 3 1 ( 3 2 ) 3 9 ) 2 4 ( 4 0 - 6 ) 1 1 - 9 - 1 0 - 1 8 ( 3 ) 3 0 ( 3 8 ) 3 4 - 2 2 ( 2 8 ( 2 1 ) 3 7 ) 1 6 - 2 3 ( 2 6 ) 3 5 / h 8 - 1 1 , 1 5 - 1 7 , 1 9 , 2 4 - 2 5 , 2 7 , 2 9 , 3 3 , 3 6 H , 1 , 1 2 - 1 4 H 2 , 2 - 7 H 3 , ( H 2 , 3 2 , 3 9 ) ( H , 3 4 , 3 8 ) / b 1 1 - 9 + , 1 8 - 1 0 - , 2 0 - 1 5 - / t 1 7 - , 1 9 + , 2 4 + , 2 5 + , 2 7 - , 2 9 + / m 1 / s 1 |
| InChIKey |
A Y U N I O R J H R X I B J - V G E U W Q N P S A - N
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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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