0Y9

(1R,2S)-1-amino-2-ethenylcyclopropanecarboxylic acid

Created:2012-09-12
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count18
Chiral Atom Count2
Bond Count18
Aromatic Bond Count0
2D diagram of 0Y9

Chemical Component Summary

Name(1R,2S)-1-amino-2-ethenylcyclopropanecarboxylic acid
Systematic Name (OpenEye OEToolkits)(1R,2S)-1-azanyl-2-ethenyl-cyclopropane-1-carboxylic acid
FormulaC6 H9 N O2
Molecular Weight127.141
TypePEPTIDE LINKING

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=C(O)C1(N)CC1\C=C
SMILESCACTVS3.370N[C]1(C[CH]1C=C)C(O)=O
SMILESOpenEye OEToolkits1.7.6C=CC1CC1(C(=O)O)N
Canonical SMILESCACTVS3.370 N[C@@]1(C[C@H]1C=C)C(O)=O
Canonical SMILESOpenEye OEToolkits1.7.6 C=C[C@@H]1C[C@@]1(C(=O)O)N
InChIInChI1.03 InChI=1S/C6H9NO2/c1-2-4-3-6(4,7)5(8)9/h2,4H,1,3,7H2,(H,8,9)/t4-,6-/m1/s1
InChIKeyInChI1.03 GALLMPFNVWUCGD-INEUFUBQSA-N

Related Resource References

Resource NameReference
PubChem 10261098, 25792364