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EKA

Summary
Name:[cyclohexyl(hydroxy)amino](oxo)acetic acid
Formula:C8 H13 N O4
Formal charge:0
Formula weight:187.193 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01[cyclohexyl(hydroxy)amino](oxo)acetic acid
OpenEye OEToolkits2.0.62-[cyclohexyl(oxidanyl)amino]-2-oxidanylidene-ethanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(C(N(C1CCCCC1)O)=O)(O)=O
InChIInChI1.03InChI=1S/C8H13NO4/c10-7(8(11)12)9(13)6-4-2-1-3-5-6/h6,13H,1-5H2,(H,11,12)
InChIKeyInChI1.03HMDGECZILRJLEV-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385ON(C1CCCCC1)C(=O)C(O)=O
SMILESCACTVS3.385ON(C1CCCCC1)C(=O)C(O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.6C1CCC(CC1)N(C(=O)C(=O)O)O
SMILESOpenEye OEToolkits2.0.6C1CCC(CC1)N(C(=O)C(=O)O)O

218500

PDB entries from 2024-04-17

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