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A1JHR

Summary
Name:Gly-Ser-epsilon-Lys
Synonyms:(2S)-2-azanyl-6-[[(2S)-2-(2-azanylethanoylamino)-3-oxidanyl-propanoyl]amino]hexanoic acid
Formula:C11 H22 N4 O5
Formal charge:0
Formula weight:290.316 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7(2~{S})-2-azanyl-6-[[(2~{S})-2-(2-azanylethanoylamino)-3-oxidanyl-propanoyl]amino]hexanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C11H22N4O5/c12-5-9(17)15-8(6-16)10(18)14-4-2-1-3-7(13)11(19)20/h7-8,16H,1-6,12-13H2,(H,14,18)(H,15,17)(H,19,20)/t7-,8-/m0/s1
InChIKeyInChI1.06OXZXXPSZOGBIGZ-YUMQZZPRSA-N
SMILES_CANONICALCACTVS3.385NCC(=O)N[C@@H](CO)C(=O)NCCCC[C@H](N)C(O)=O
SMILESCACTVS3.385NCC(=O)N[CH](CO)C(=O)NCCCC[CH](N)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7C(CCNC(=O)[C@H](CO)NC(=O)CN)C[C@@H](C(=O)O)N
SMILESOpenEye OEToolkits2.0.7C(CCNC(=O)C(CO)NC(=O)CN)CC(C(=O)O)N

250059

PDB entries from 2026-03-04

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