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62H

Summary
Name:(2S)-3-amino-2-methylpropanoic acid
Formula:C4 H9 N O2
Formal charge:0
Formula weight:103.12 Da
Component type:L-peptide linking

Chemical Identifiers

ProgramVersionName
ACDLabs12.01(2S)-3-amino-2-methylpropanoic acid
OpenEye OEToolkits2.0.4(2~{S})-3-azanyl-2-methyl-propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01NCC(C(=O)O)C
InChIInChI1.03InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
InChIKeyInChI1.03QCHPKSFMDHPSNR-VKHMYHEASA-N
SMILES_CANONICALCACTVS3.385C[C@@H](CN)C(O)=O
SMILESCACTVS3.385C[CH](CN)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.4C[C@@H](CN)C(=O)O
SMILESOpenEye OEToolkits2.0.4CC(CN)C(=O)O

217705

PDB entries from 2024-03-27

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