TYB
Summary
| Name: | TYROSINAL |
| Formula: | C9 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 165.189 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-2-amino-3-(4-hydroxyphenyl)propanal |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-3-(4-hydroxyphenyl)propanal |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=CC(N)Cc1ccc(O)cc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](Cc1ccc(O)cc1)C=O |
| SMILES | CACTVS | 3.341 | N[CH](Cc1ccc(O)cc1)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C[C@@H](C=O)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CC(C=O)N)O |
| InChI | InChI | 1.03 | InChI=1S/C9H11NO2/c10-8(6-11)5-7-1-3-9(12)4-2-7/h1-4,6,8,12H,5,10H2/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | DXGAIOIQACHYRK-QMMMGPOBSA-N |
