4J2
Summary
| Name: | (2R)-2-amino-3-(naphthalen-2-yl)propanoic acid |
| Formula: | C13 H13 N O2 |
| Formal charge: | 0 |
| Formula weight: | 215.248 Da |
| Component type: | D-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2-amino-3-(naphthalen-2-yl)propanoic acid (non-preferred name) |
| OpenEye OEToolkits | 1.7.6 | (2R)-2-azanyl-3-naphthalen-2-yl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(Cc1ccc2ccccc2c1)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C13H13NO2/c14-12(13(15)16)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8,14H2,(H,15,16)/t12-/m1/s1 |
| InChIKey | InChI | 1.03 | JPZXHKDZASGCLU-GFCCVEGCSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](Cc1ccc2ccccc2c1)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](Cc1ccc2ccccc2c1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2cc(ccc2c1)C[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2cc(ccc2c1)CC(C(=O)O)N |
