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

Details

Stereochemistry ABSOLUTE
Molecular Formula C12H19NO2
Molecular Weight 209.2848
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MIROGABALIN

SMILES

[H][C@@]12C[C@](CN)(CC(O)=O)[C@]1([H])C=C(CC)C2

InChI

InChIKey=FTBQORVNHOIASH-CKYFFXLPSA-N
InChI=1S/C12H19NO2/c1-2-8-3-9-5-12(7-13,6-11(14)15)10(9)4-8/h4,9-10H,2-3,5-7,13H2,1H3,(H,14,15)/t9-,10-,12-/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H19NO2
Molecular Weight 209.2848
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:58:31 UTC 2023
Edited
by admin
on Sat Dec 16 08:58:31 UTC 2023
Record UNII
S7LK2KDM5U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MIROGABALIN
INN   USAN  
INN   USAN  
Official Name English
A-200-0700
Code English
MIROGABALIN [USAN]
Common Name English
BICYCLO(3.2.0)HEPT-3-ENE-6-ACETIC ACID, 6-(AMINOMETHYL)-3-ETHYL-, (1R,5S,6S)-
Common Name English
A200-0700
Code English
[(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid
Systematic Name English
mirogabalin [INN]
Common Name English
Mirogabalin [WHO-DD]
Common Name English
Code System Code Type Description
INN
9767
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
DRUG BANK
DB11825
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
USAN
CD-59
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
WIKIPEDIA
Mirogabalin
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
EPA CompTox
DTXSID001032301
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
FDA UNII
S7LK2KDM5U
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
SMS_ID
300000024918
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
ChEMBL
CHEMBL3545125
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
NCI_THESAURUS
C170186
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
CAS
1138245-13-2
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
PUBCHEM
59509752
Created by admin on Sat Dec 16 08:58:31 UTC 2023 , Edited by admin on Sat Dec 16 08:58:31 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET->LIGAND
TARGET->LIGAND
Related Record Type Details
ACTIVE MOIETY