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A01

Summary
Name:[(2,6-DIMETHOXYPHENYL)CARBONYLAMINO]METHYL-TRIHYDROXY-BORON
Formula:C10 H15 B N O6
Formal charge:-1
Formula weight:256.04 Da
Component type:non-polymer

Chemical Identifiers

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

Chemical Descriptors

TypeProgramVersionDescriptor
SMILES_CANONICALCACTVS3.352COc1cccc(OC)c1C(=O)NC[B-](O)(O)O
SMILESCACTVS3.352COc1cccc(OC)c1C(=O)NC[B-](O)(O)O
SMILES_CANONICALOpenEye OEToolkits1.6.1[B-](CNC(=O)c1c(cccc1OC)OC)(O)(O)O
SMILESOpenEye OEToolkits1.6.1[B-](CNC(=O)c1c(cccc1OC)OC)(O)(O)O
InChIInChI1.03InChI=1S/C10H15BNO6/c1-17-7-4-3-5-8(18-2)9(7)10(13)12-6-11(14,15)16/h3-5,14-16H,6H2,1-2H3,(H,12,13)/q-1
InChIKeyInChI1.03DRHCTIJAENVGEN-UHFFFAOYSA-N

223532

PDB entries from 2024-08-07

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