Details
Stereochemistry | RACEMIC |
Molecular Formula | C12H13N3O.ClH |
Molecular Weight | 251.712 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.OC(CNC1=NC=CC=N1)C2=CC=CC=C2
InChI
InChIKey=MEDWIGMHHZRIOP-UHFFFAOYSA-N
InChI=1S/C12H13N3O.ClH/c16-11(10-5-2-1-3-6-10)9-15-12-13-7-4-8-14-12;/h1-8,11,16H,9H2,(H,13,14,15);1H
Molecular Formula | C12H13N3O |
Molecular Weight | 215.2511 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Sample Use Guides
In Vivo Use Guide
Sources: https://www.lookchem.com/Fenyripol-hydrochloride/
Curator's Comment: Toxicity data in mice.
LD50 intravenous 125 mg/kg. LD50 oral 850 mg/kg.
Route of Administration:
Other
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 14:58:51 GMT 2023
by
admin
on
Fri Dec 15 14:58:51 GMT 2023
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Record UNII |
R4I084C0NO
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29696
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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17118
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CHEMBL2110896
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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43183
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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R4I084C0NO
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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2441-88-5
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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C80984
Created by
admin on Fri Dec 15 14:58:51 GMT 2023 , Edited by admin on Fri Dec 15 14:58:51 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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ENANTIOMER -> RACEMATE | |||
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ENANTIOMER -> RACEMATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |