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ZA5

Summary
Name:[(2,6-DIFLUOROPHENYL)CARBONYLAMINO]METHYL-TRIHYDROXY-BORON
Formula:C8 H9 B F2 N O4
Formal charge:-1
Formula weight:231.969 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits1.6.1[(2,6-difluorophenyl)carbonylamino]methyl-trihydroxy-boron

Chemical Descriptors

TypeProgramVersionDescriptor
SMILES_CANONICALCACTVS3.352O[B-](O)(O)CNC(=O)c1c(F)cccc1F
SMILESCACTVS3.352O[B-](O)(O)CNC(=O)c1c(F)cccc1F
SMILES_CANONICALOpenEye OEToolkits1.6.1[B-](CNC(=O)c1c(cccc1F)F)(O)(O)O
SMILESOpenEye OEToolkits1.6.1[B-](CNC(=O)c1c(cccc1F)F)(O)(O)O
InChIInChI1.03InChI=1S/C8H9BF2NO4/c10-5-2-1-3-6(11)7(5)8(13)12-4-9(14,15)16/h1-3,14-16H,4H2,(H,12,13)/q-1
InChIKeyInChI1.03WTOJBPXTZMRWEB-UHFFFAOYSA-N

223532

PDB entries from 2024-08-07

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