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8KW

Summary
Name:3-[2-(2-hydroxyphenyl)ethyl]-5-methoxy-phenol
Formula:C15 H16 O3
Formal charge:0
Formula weight:244.286 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.63-[2-(2-hydroxyphenyl)ethyl]-5-methoxy-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C15H16O3/c1-18-14-9-11(8-13(16)10-14)6-7-12-4-2-3-5-15(12)17/h2-5,8-10,16-17H,6-7H2,1H3
InChIKeyInChI1.03IUMFLNFLJUUODE-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cc(O)cc(CCc2ccccc2O)c1
SMILESCACTVS3.385COc1cc(O)cc(CCc2ccccc2O)c1
SMILES_CANONICALOpenEye OEToolkits2.0.6COc1cc(cc(c1)O)CCc2ccccc2O
SMILESOpenEye OEToolkits2.0.6COc1cc(cc(c1)O)CCc2ccccc2O

218853

PDB entries from 2024-04-24

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