0Y9
(1R,2S)-1-amino-2-ethenylcyclopropanecarboxylic acid
| Created: | 2012-09-12 |
| Last modified: | 2024-09-27 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 18 |
| Chiral Atom Count | 2 |
| Bond Count | 18 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | (1R,2S)-1-amino-2-ethenylcyclopropanecarboxylic acid |
| Systematic Name (OpenEye OEToolkits) | (1R,2S)-1-azanyl-2-ethenyl-cyclopropane-1-carboxylic acid |
| Formula | C6 H9 N O2 |
| Molecular Weight | 127.141 |
| Type | PEPTIDE LINKING |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1(N)CC1\C=C |
| SMILES | CACTVS | 3.370 | N[C]1(C[CH]1C=C)C(O)=O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C=CC1CC1(C(=O)O)N |
| Canonical SMILES | CACTVS | 3.370 | N[C@@]1(C[C@H]1C=C)C(O)=O |
| Canonical SMILES | OpenEye OEToolkits | 1.7.6 | C=C[C@@H]1C[C@@]1(C(=O)O)N |
| InChI | InChI | 1.03 | 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 |
| InChIKey | InChI | 1.03 | GALLMPFNVWUCGD-INEUFUBQSA-N |
Related Resource References
| Resource Name | Reference |
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| PubChem | 10261098, 25792364 |














