Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

F9G

Summary
Name:5-bromo-2-methoxyphenol
Formula:C7 H7 Br O2
Formal charge:0
Formula weight:203.033 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-bromo-2-methoxyphenol
OpenEye OEToolkits2.0.65-bromanyl-2-methoxy-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(c(ccc(c1)Br)OC)O
InChIInChI1.03InChI=1S/C7H7BrO2/c1-10-7-3-2-5(8)4-6(7)9/h2-4,9H,1H3
InChIKeyInChI1.03OLSJHVZRUFFIPL-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(Br)cc1O
SMILESCACTVS3.385COc1ccc(Br)cc1O
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1ccc(cc1O)Br
SMILESOpenEye OEToolkits2.0.6COc1ccc(cc1O)Br

222926

数据于2024-07-24公开中

PDB statisticsPDBj update infoContact PDBjnumon