0AB
Summary
| Name: | (3S,4S)-3-amino-4-methyl-3,4-dihydro-2H-pyran-2-one |
| Formula: | C6 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 127.141 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (3S,4S)-3-amino-4-methyl-3,4-dihydro-2H-pyran-2-one |
| OpenEye OEToolkits | 1.5.0 | (3S,4S)-3-amino-4-methyl-3,4-dihydropyran-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1OC=CC(C)C1N |
| SMILES_CANONICAL | CACTVS | 3.341 | C[C@H]1C=COC(=O)[C@H]1N |
| SMILES | CACTVS | 3.341 | C[CH]1C=COC(=O)[CH]1N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H]1C=COC(=O)[C@H]1N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1C=COC(=O)C1N |
| InChI | InChI | 1.03 | InChI=1S/C6H9NO2/c1-4-2-3-9-6(8)5(4)7/h2-5H,7H2,1H3/t4-,5-/m0/s1 |
| InChIKey | InChI | 1.03 | SBDJAXOULWQEQY-WHFBIAKZSA-N |
