D4P
Summary
| Name: | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID |
| Formula: | C8 H9 N O3 |
| Formal charge: | 0 |
| Formula weight: | 167.162 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2S)-amino(4-hydroxyphenyl)ethanoic acid |
| OpenEye OEToolkits | 1.5.0 | (2S)-2-amino-2-(4-hydroxyphenyl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(N)c1ccc(O)cc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@H](C(O)=O)c1ccc(O)cc1 |
| SMILES | CACTVS | 3.341 | N[CH](C(O)=O)c1ccc(O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1[C@@H](C(=O)O)N)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C(C(=O)O)N)O |
| InChI | InChI | 1.03 | InChI=1S/C8H9NO3/c9-7(8(11)12)5-1-3-6(10)4-2-5/h1-4,7,10H,9H2,(H,11,12)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | LJCWONGJFPCTTL-ZETCQYMHSA-N |
