03E
1-aminocycloheptanecarboxylic acid
| Created: | 2011-08-14 |
| Last modified: | 2024-09-27 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 26 |
| Chiral Atom Count | 0 |
| Bond Count | 26 |
| Aromatic Bond Count | 0 |
Chemical Component Summary | |
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| Name | 1-aminocycloheptanecarboxylic acid |
| Systematic Name (OpenEye OEToolkits) | 1-azanylcycloheptane-1-carboxylic acid |
| Formula | C8 H15 N O2 |
| Molecular Weight | 157.21 |
| Type | PEPTIDE LINKING |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1(N)CCCCCC1 |
| SMILES | CACTVS | 3.370 | NC1(CCCCCC1)C(O)=O |
| SMILES | OpenEye OEToolkits | 1.7.2 | C1CCCC(CC1)(C(=O)O)N |
| Canonical SMILES | CACTVS | 3.370 | NC1(CCCCCC1)C(O)=O |
| Canonical SMILES | OpenEye OEToolkits | 1.7.2 | C1CCCC(CC1)(C(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H15NO2/c9-8(7(10)11)5-3-1-2-4-6-8/h1-6,9H2,(H,10,11) |
| InChIKey | InChI | 1.03 | IINRZEIPFQHEAP-UHFFFAOYSA-N |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 23378, 7128342 |














