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IDL

Summary
Name:imidazo[1,2-a]pyridin-3-ylacetic acid
Formula:C9 H8 N2 O2
Formal charge:0
Formula weight:176.172 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01imidazo[1,2-a]pyridin-3-ylacetic acid
OpenEye OEToolkits1.7.62-imidazo[1,2-a]pyridin-3-ylethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)Cc1cnc2ccccn12
InChIInChI1.03InChI=1S/C9H8N2O2/c12-9(13)5-7-6-10-8-3-1-2-4-11(7)8/h1-4,6H,5H2,(H,12,13)
InChIKeyInChI1.03ZVBVKRNOISRONE-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370OC(=O)Cc1cnc2ccccn12
SMILESCACTVS3.370OC(=O)Cc1cnc2ccccn12
SMILES_CANONICALOpenEye OEToolkits1.7.6c1ccn2c(c1)ncc2CC(=O)O
SMILESOpenEye OEToolkits1.7.6c1ccn2c(c1)ncc2CC(=O)O

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数据于2024-07-17公开中

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