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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24N2O2
Molecular Weight 312.4061
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PALONOSETRON N-OXIDE

SMILES

[H][C@]12CCCC3=C1C(=CC=C3)C(=O)N(C2)[C@@H]4C[N+]5([O-])CCC4CC5

InChI

InChIKey=IQQIWUDYGYXXEA-BGAFOXLKSA-N
InChI=1S/C19H24N2O2/c22-19-16-6-2-4-14-3-1-5-15(18(14)16)11-20(19)17-12-21(23)9-7-13(17)8-10-21/h2,4,6,13,15,17H,1,3,5,7-12H2/t13?,15-,17-,21?/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H24N2O2
Molecular Weight 312.4061
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 13:58:44 UTC 2023
Edited
by admin
on Sat Dec 16 13:58:44 UTC 2023
Record UNII
MIV4QW9F6J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PALONOSETRON N-OXIDE
Common Name English
PALONOSETRON RELATED COMPOUND A
Common Name English
PALONOSETRON METABOLITE M9
Common Name English
PALONOSETRON RELATED COMPOUND A [USP-RS]
Common Name English
(3AS)-1-OXO-2-((3S)-QUINUCLIDIN-3-YL)-2,3,3A,4,5,6-HEXAHYDRO-1H-BENZO(DE)ISOQUINOLINE 1-OXIDE
Systematic Name English
1H-BENZ(DE)ISOQUINOLIN-1-ONE, 2,3,3A,4,5,6-HEXAHYDRO-2-((3S)-1-OXIDO-1-AZABICYCLO(2.2.2)OCT-3-YL)-, (3AS)-
Systematic Name English
PALONOSETRON METABOLITE (N-OXIDE-PALONOSETRON )
Common Name English
Code System Code Type Description
PUBCHEM
46782681
Created by admin on Sat Dec 16 13:58:44 UTC 2023 , Edited by admin on Sat Dec 16 13:58:44 UTC 2023
PRIMARY
RS_ITEM_NUM
1492222
Created by admin on Sat Dec 16 13:58:44 UTC 2023 , Edited by admin on Sat Dec 16 13:58:44 UTC 2023
PRIMARY
FDA UNII
MIV4QW9F6J
Created by admin on Sat Dec 16 13:58:44 UTC 2023 , Edited by admin on Sat Dec 16 13:58:44 UTC 2023
PRIMARY
CAS
813425-83-1
Created by admin on Sat Dec 16 13:58:44 UTC 2023 , Edited by admin on Sat Dec 16 13:58:44 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE LESS ACTIVE
The metabolite has less than 1% of the 5-HT3 receptor antagonist activity of palonosetron.
Related Record Type Details
PARENT -> IMPURITY