1HB
Summary
| Name: | (4S)-4-amino-5-hydroxy-N,N-dimethylpentanamide |
| Synonyms: | N,N-dimethyl-L-glutamine aldehyde, bound form |
| Formula: | C7 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 160.214 Da |
| Component type: | peptide-like |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4S)-4-amino-5-hydroxy-N,N-dimethylpentanamide |
| OpenEye OEToolkits | 1.7.6 | (4S)-4-azanyl-N,N-dimethyl-5-oxidanyl-pentanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(N(C)C)CCC(N)CO |
| InChI | InChI | 1.03 | InChI=1S/C7H16N2O2/c1-9(2)7(11)4-3-6(8)5-10/h6,10H,3-5,8H2,1-2H3/t6-/m0/s1 |
| InChIKey | InChI | 1.03 | MLUJTSZAHCOXIF-LURJTMIESA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CN(C)C(=O)CC[C@H](N)CO |
| SMILES | CACTVS | 3.370 | CN(C)C(=O)CC[CH](N)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN(C)C(=O)CC[C@@H](CO)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN(C)C(=O)CCC(CO)N |
