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WUE

Summary
Name:(2~{S})-2-(4-naphthalen-1-ylphenoxy)-3-phenyl-propanoic acid
Formula:C25 H20 O3
Formal charge:0
Formula weight:368.425 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S})-2-(4-naphthalen-1-ylphenoxy)-3-phenyl-propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C25H20O3/c26-25(27)24(17-18-7-2-1-3-8-18)28-21-15-13-20(14-16-21)23-12-6-10-19-9-4-5-11-22(19)23/h1-16,24H,17H2,(H,26,27)/t24-/m0/s1
InChIKeyInChI1.06UDWUKDKWHIAYOW-DEOSSOPVSA-N
SMILES_CANONICALCACTVS3.385OC(=O)[C@H](Cc1ccccc1)Oc2ccc(cc2)c3cccc4ccccc34
SMILESCACTVS3.385OC(=O)[CH](Cc1ccccc1)Oc2ccc(cc2)c3cccc4ccccc34
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)C[C@@H](C(=O)O)Oc2ccc(cc2)c3cccc4c3cccc4
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)CC(C(=O)O)Oc2ccc(cc2)c3cccc4c3cccc4

250359

PDB entries from 2026-03-11

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