Details
Stereochemistry | ACHIRAL |
Molecular Formula | C24H31N3O2.C4H4O4 |
Molecular Weight | 509.594 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN1[C@H]2CC[C@@H]1C[C@@H](C2)NC(=O)C3=CN(C4CCCCC4)C5=C(C=CC=C5)C3=O
InChI
InChIKey=OQIHDZMOAKTHKW-HNJJWOJJSA-N
InChI=1S/C24H31N3O2.C4H4O4/c1-26-18-11-12-19(26)14-16(13-18)25-24(29)21-15-27(17-7-3-2-4-8-17)22-10-6-5-9-20(22)23(21)28;5-3(6)1-2-4(7)8/h5-6,9-10,15-19H,2-4,7-8,11-14H2,1H3,(H,25,29);1-2H,(H,5,6)(H,7,8)/b;2-1-/t16-,18+,19-;
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C24H31N3O2 |
Molecular Weight | 393.5218 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Mirisetron (also known as WAY-100579) was developed as 5-HT3 receptor antagonist by Wyeth-Ayerst in the USA. This drug participated in clinical trials phase I for the treatment of anxiety disorders and for sleep disorders. In addition, in preclinical studies, the drug was used in cognition disorders. However, all these studies were discontinued.
Originator
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:30:41 GMT 2023
by
admin
on
Fri Dec 15 16:30:41 GMT 2023
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Record UNII |
0B4615FL1S
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Record Status |
Validated (UNII)
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Record Version |
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-
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C104926
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0B4615FL1S
Created by
admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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6435818
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admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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148611-75-0
Created by
admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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FF-83
Created by
admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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CHEMBL2110961
Created by
admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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C175141
Created by
admin on Fri Dec 15 16:30:41 GMT 2023 , Edited by admin on Fri Dec 15 16:30:41 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |
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