0XL

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Summary

Name:2-amino-2-ethylbutanoic acid
Formula:C6 H13 N O2
Formal charge:0
Molecular weight:131.173 Da
Component type:PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-amino-2-ethylbutanoic acid
OpenEye OEToolkits1.7.62-azanyl-2-ethyl-butanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)C(N)(CC)CC
InChIInChI1.03InChI=1S/C6H13NO2/c1-3-6(7,4-2)5(8)9/h3-4,7H2,1-2H3,(H,8,9)
InChIKeyInChI1.03KWOMLHIFHFWBSB-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370CCC(N)(CC)C(O)=O
SMILESCACTVS3.370CCC(N)(CC)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.7.6CCC(CC)(C(=O)O)N
SMILESOpenEye OEToolkits1.7.6CCC(CC)(C(=O)O)N
167518
PDB entries from 2020-08-12