2DO
Summary
| Name: | (2S)-2-AMINOHEXANE-1,1-DIOL |
| Formula: | C6 H15 N O2 |
| Formal charge: | 0 |
| Formula weight: | 133.189 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-2-aminohexane-1,1-diol |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-aminohexane-1,1-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OC(O)C(N)CCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCC[C@H](N)C(O)O |
| SMILES | CACTVS | 3.341 | CCCC[CH](N)C(O)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCC[C@@H](C(O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCC(C(O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C6H15NO2/c1-2-3-4-5(7)6(8)9/h5-6,8-9H,2-4,7H2,1H3/t5-/m0/s1 |
| InChIKey | InChI | 1.03 | SUCLLBDDWGZXQQ-YFKPBYRVSA-N |
