compound 3b [PMID: 24946214] (Q27076614)

CHEMBL3287940 (English)

3 October 2016

chemical formula

C₁₇H₂₃BN₂O₄

1 reference

CHEMBL3287940 (English)

3 October 2016

canonical SMILES

B(C(CC(C)C)NC(=O)CCN1C=CC2=CC=CC=C2C1=O)(O)O

1 reference

CHEMBL3287940 (English)

3 October 2016

isomeric SMILES

B([C@H](CC(C)C)NC(=O)CCN1C=CC2=CC=CC=C2C1=O)(O)O

1 reference

CHEMBL3287940 (English)

InChI=1S/C17H23BN2O4/c1-12(2)11-15(18(23)24)19-16(21)8-10-20-9-7-13-5-3-4-6-14(13)17(20)22/h3-7,9,12,15,23-24H,8,10-11H2,1-2H3,(H,19,21)/t15-/m0/s1

3 October 2016

Identifiers

InChI

1 reference

CHEMBL3287940 (English)

QCKLWTRAVKQTPI-HNNXBMFYSA-N

3 October 2016

InChIKey

1 reference

CHEMBL3287940 (English)

3 October 2016

1 reference

[(1R)-3-Methyl-1-{[3-(1-oxo-2(1H)-isoquinolinyl)propanoyl]amino}butyl]boronic acid (English)

3 October 2016

1 reference

CHEMBL3287940 (English)

3 October 2016

1 reference

Guide to Pharmacology Ligand ID

CHEMBL3287940 (English)

3 October 2016

1 reference

8618

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

8618

compound 3b [PMID: 24946214] (English)