U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C8H13NO2
Molecular Weight 155.1943
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISORETRONECANOLIC ACID, (+)-

SMILES

OC(=O)[C@@H]1CCN2CCC[C@H]12

InChI

InChIKey=BZYGCNOHXFJSTG-RNFRBKRXSA-N
InChI=1S/C8H13NO2/c10-8(11)6-3-5-9-4-1-2-7(6)9/h6-7H,1-5H2,(H,10,11)/t6-,7-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(+)-ISORETRONECAN-9-OIC ACID
Preferred Name English
ISORETRONECANOLIC ACID, (+)-
Common Name English
1H-PYRROLIZINE-1-CARBOXYLIC ACID, HEXAHYDRO-, (1R-TRANS)-
Systematic Name English
1H-PYRROLIZINE-1-CARBOXYLIC ACID, HEXAHYDRO-, (1R,7AR)-
Systematic Name English
Code System Code Type Description
CAS
22269-14-3
Created by admin on Tue Apr 01 23:24:29 GMT 2025 , Edited by admin on Tue Apr 01 23:24:29 GMT 2025
PRIMARY
FDA UNII
FIO0C6RO2K
Created by admin on Tue Apr 01 23:24:29 GMT 2025 , Edited by admin on Tue Apr 01 23:24:29 GMT 2025
PRIMARY
PUBCHEM
12304360
Created by admin on Tue Apr 01 23:24:29 GMT 2025 , Edited by admin on Tue Apr 01 23:24:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID00486709
Created by admin on Tue Apr 01 23:24:29 GMT 2025 , Edited by admin on Tue Apr 01 23:24:29 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966