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ZPO

Summary
Name:pyrazolidine-1-carboxylic acid
Formula:C4 H8 N2 O2
Formal charge:0
Formula weight:116.119 Da
Component type:peptide-like

Chemical Identifiers

ProgramVersionName
ACDLabs12.01pyrazolidine-1-carboxylic acid
OpenEye OEToolkits2.0.6pyrazolidine-1-carboxylic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N1CCCN1C(O)=O
InChIInChI1.03InChI=1S/C4H8N2O2/c7-4(8)6-3-1-2-5-6/h5H,1-3H2,(H,7,8)
InChIKeyInChI1.03FNNIAKKPBXJGNJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC(=O)N1CCCN1
SMILESCACTVS3.385OC(=O)N1CCCN1
SMILES_CANONICALOpenEye OEToolkits2.0.6C1CNN(C1)C(=O)O
SMILESOpenEye OEToolkits2.0.6C1CNN(C1)C(=O)O

222415

數據於2024-07-10公開中

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