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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H11NO2
Molecular Weight 189.2105
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-KETO-AAI

SMILES

CC(=O)N[C@@H]1CC(=O)C2=C1C=CC=C2

InChI

InChIKey=UWLRPXYSWRKGTA-SNVBAGLBSA-N
InChI=1S/C11H11NO2/c1-7(13)12-10-6-11(14)9-5-3-2-4-8(9)10/h2-5,10H,6H2,1H3,(H,12,13)/t10-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H11NO2
Molecular Weight 189.2105
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:35:51 UTC 2023
Edited
by admin
on Sat Dec 16 14:35:51 UTC 2023
Record UNII
KQ9RMG9C52
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-KETO-AAI
Common Name English
N-((1R)-3-OXOINDAN-1-YL)ACETAMIDE
Systematic Name English
RASAGILINE METABOLITE, 3-KETO-AAI
Common Name English
Code System Code Type Description
PUBCHEM
93234149
Created by admin on Sat Dec 16 14:35:51 UTC 2023 , Edited by admin on Sat Dec 16 14:35:51 UTC 2023
PRIMARY
FDA UNII
KQ9RMG9C52
Created by admin on Sat Dec 16 14:35:51 UTC 2023 , Edited by admin on Sat Dec 16 14:35:51 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE