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KGC

Summary
Name:N~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN-2-YL]-L-LYSINE
Formula:C11 H18 N2 O6
Formal charge:0
Formula weight:274.27 Da
Component type:L-PEPTIDE LINKING

Chemical Identifiers

ProgramVersionName
ACDLabs10.04N~6~-[(2R)-2-carboxy-5-oxotetrahydrofuran-2-yl]-L-lysine
OpenEye OEToolkits1.5.0(2R)-2-[[(5S)-5-amino-6-hydroxy-6-oxo-hexyl]amino]-5-oxo-oxolane-2-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)C1(OC(=O)CC1)NCCCCC(C(=O)O)N
SMILES_CANONICALCACTVS3.341N[C@@H](CCCCN[C@@]1(CCC(=O)O1)C(O)=O)C(O)=O
SMILESCACTVS3.341N[CH](CCCCN[C]1(CCC(=O)O1)C(O)=O)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C1C[C@@](OC1=O)(C(=O)O)NCCCC[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits1.5.0C1CC(OC1=O)(C(=O)O)NCCCCC(C(=O)O)N
InChIInChI1.03InChI=1S/C11H18N2O6/c12-7(9(15)16)3-1-2-6-13-11(10(17)18)5-4-8(14)19-11/h7,13H,1-6,12H2,(H,15,16)(H,17,18)/t7-,11+/m0/s1
InChIKeyInChI1.03FASAFSZOFNKRIC-WRWORJQWSA-N

224931

数据于2024-09-11公开中

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