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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24N2O
Molecular Weight 296.4067
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PALONOSETRON, (3AR)-

SMILES

[H][C@@]12CCCC3=C1C(=CC=C3)C(=O)N(C2)[C@@H]4CN5CCC4CC5

InChI

InChIKey=CPZBLNMUGSZIPR-DOTOQJQBSA-N
InChI=1S/C19H24N2O/c22-19-16-6-2-4-14-3-1-5-15(18(14)16)11-21(19)17-12-20-9-7-13(17)8-10-20/h2,4,6,13,15,17H,1,3,5,7-12H2/t15-,17+/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H24N2O
Molecular Weight 296.4067
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:46:52 GMT 2023
Edited
by admin
on Sat Dec 16 13:46:52 GMT 2023
Record UNII
YZS3R7LP44
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PALONOSETRON, (3AR)-
Common Name English
1H-BENZ(DE)ISOQUINOLIN-1-ONE, 2-(3S)-1-AZABICYCLO(2.2.2)OCT-3-YL-2,3,3A,4,5,6-HEXAHYDRO-, (3AR)-
Systematic Name English
Code System Code Type Description
PUBCHEM
148211
Created by admin on Sat Dec 16 13:46:52 GMT 2023 , Edited by admin on Sat Dec 16 13:46:52 GMT 2023
PRIMARY
FDA UNII
YZS3R7LP44
Created by admin on Sat Dec 16 13:46:52 GMT 2023 , Edited by admin on Sat Dec 16 13:46:52 GMT 2023
PRIMARY
CAS
135729-73-6
Created by admin on Sat Dec 16 13:46:52 GMT 2023 , Edited by admin on Sat Dec 16 13:46:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID701331918
Created by admin on Sat Dec 16 13:46:52 GMT 2023 , Edited by admin on Sat Dec 16 13:46:52 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT