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ASN

Summary
Name:ASPARAGINE
Formula:C4 H8 N2 O3
Formal charge:0
Formula weight:132.118 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs12.01L-asparagine
OpenEye OEToolkits1.7.2(2S)-2,4-bis(azanyl)-4-oxidanylidene-butanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(N)CC(N)C(=O)O
InChIInChI1.03InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1
InChIKeyInChI1.03DCXYFEDJOCDNAF-REOHCLBHSA-N
SMILES_CANONICALCACTVS3.370N[C@@H](CC(N)=O)C(O)=O
SMILESCACTVS3.370N[CH](CC(N)=O)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.7.2C([C@@H](C(=O)O)N)C(=O)N
SMILESOpenEye OEToolkits1.7.2C(C(C(=O)O)N)C(=O)N

217705

PDB entries from 2024-03-27

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