N80

1-ethenyl-L-proline

Created:2014-11-25
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count1
Bond Count21
Aromatic Bond Count0
2D diagram of N80

Chemical Component Summary

Name1-ethenyl-L-proline
Systematic Name (OpenEye OEToolkits)(2S)-1-ethenylpyrrolidine-2-carboxylic acid
FormulaC7 H11 N O2
Molecular Weight141.168
TypeL-PEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)C1N(\C=C)CCC1
SMILESCACTVS3.385OC(=O)[CH]1CCCN1C=C
SMILESOpenEye OEToolkits1.9.2C=CN1CCCC1C(=O)O
Canonical SMILESCACTVS3.385 OC(=O)[C@@H]1CCCN1C=C
Canonical SMILESOpenEye OEToolkits1.9.2 C=CN1CCC[C@H]1C(=O)O
InChIInChI1.03 InChI=1S/C7H11NO2/c1-2-8-5-3-4-6(8)7(9)10/h2,6H,1,3-5H2,(H,9,10)/t6-/m0/s1
InChIKeyInChI1.03 XOTIFFOSEYHBBR-LURJTMIESA-N

Related Resource References

Resource NameReference
PubChem 21144660