XC0
Summary
| Name: | (2S)-2-aminooctanoic acid |
| Formula: | C8 H17 N O2 |
| Formal charge: | 0 |
| Formula weight: | 159.226 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-2-aminooctanoic acid |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyloctanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(CCCCCC)C(=O)O |
| InChI | InChI | 1.06 | InChI=1S/C8H17NO2/c1-2-3-4-5-6-7(9)8(10)11/h7H,2-6,9H2,1H3,(H,10,11)/t7-/m0/s1 |
| InChIKey | InChI | 1.06 | AKVBCGQVQXPRLD-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCC[C@H](N)C(O)=O |
| SMILES | CACTVS | 3.385 | CCCCCC[CH](N)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCC[C@@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCC(C(=O)O)N |
