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OKE

Summary
Name:2-(hydroxymethyl)-6-methoxy-phenol
Synonyms:o-vanillin
Formula:C8 H10 O3
Formal charge:0
Formula weight:154.163 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.72-(hydroxymethyl)-6-methoxy-phenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H10O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-4,9-10H,5H2,1H3
InChIKeyInChI1.03OSZHSESNQIMXMZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1cccc(CO)c1O
SMILESCACTVS3.385COc1cccc(CO)c1O
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1cccc(c1O)CO
SMILESOpenEye OEToolkits2.0.7COc1cccc(c1O)CO

222415

PDB entries from 2024-07-10

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