Mirogabalin besylate structure, CAS 1138245-21-2

Mirogabalin besylate

CAS Number1138245-21-2

SynonymsMirogabalin besylate; [(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid benzenesulfonate (1:1)

Molecular FormulaC18H25O5N1S1

Molecular Weight367.47

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Cat. No.: 2A-3186993 Purity:
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Chemical & Physical Properties
CAS Number1138245-21-2
Catalog No.2A-3186993
Chinese Name苯磺酸美洛加巴林
SynonymsMirogabalin besylate; [(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid benzenesulfonate (1:1)
Molecular FormulaC18H25O5N1S1
Molecular Weight367.47
Storage Condition2-8℃
ApplicationMirogabalin besylate is a selective, orally available, potent ligand for voltage-gated calcium channels subunit α2δ, with Kd values ​​of 13.5 nM, 22.7 nM, 27 nM and 47.6 nM for human α2δ-1 and α2δ-2,
PubChem ID215269410
MDL NumberMFCD31631215
SMILESCCC1=CC2C(C1)CC2(CN)CC(=O)O.O=S(=O)(O)c1ccccc1
InChIInChI=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
InChI KeyOKJXJRVWXYRSAN-TXULWXBWSA-N
Transport InfoProduct name: Mirogabalin besylate
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