MIROGABALIN BESYLATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C12H19NO2.C6H6O3S
Molecular Weight	367.46
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(=O)(=O)C1=CC=CC=C1.[H][C@@]23C[C@](CN)(CC(O)=O)[C@]2([H])C=C(CC)C3

InChI

InChIKey=OKJXJRVWXYRSAN-TXULWXBWSA-N

InChI=1S/C12H19NO2.C6H6O3S/c1-2-8-3-9-5-12(7-13,6-11(14)15)10(9)4-8;7-10(8,9)6-4-2-1-3-5-6/h4,9-10H,2-3,5-7,13H2,1H3,(H,14,15);1-5H,(H,7,8,9)/t9-,10-,12-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C6H6O3S
Molecular Weight	158.175
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

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 09:17:10 UTC 2023` Edited by `admin` on `Sat Dec 16 09:17:10 UTC 2023`
Record UNII	01F4FRP8YL
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MIROGABALIN BESYLATE

Official Name

English

BICYCLO(3.2.0)HEPT-3-ENE-6-ACETIC ACID, 6-(AMINOMETHYL)-3-ETHYL-, (1R,5S,6S)-, BENZENESULFONATE (1:1)

Systematic Name

English

MIROGABALIN BESYLATE [USAN]

Common Name

English

Mirogabalin besilate [WHO-DD]

Common Name

English

[(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid monobenzenesulfonate

Systematic Name

English

MIROGABALIN BESILATE [JAN]

Common Name

English

DS5565

Code

English

Mirogabalin besilate

Common Name

English

DS-5565

Code

English

Code System Code Type Description

USAN

CD-60