OV7
Summary
| Name: | (2R)-amino[(carboxymethyl)sulfanyl]acetic acid |
| Formula: | C4 H7 N O4 S |
| Formal charge: | 0 |
| Formula weight: | 165.168 Da |
| Component type: | D-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-amino[(carboxymethyl)sulfanyl]acetic acid |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-azanyl-2-(2-hydroxy-2-oxoethylsulfanyl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NC(C(O)=O)SCC(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C4H7NO4S/c5-3(4(8)9)10-1-2(6)7/h3H,1,5H2,(H,6,7)(H,8,9)/t3-/m1/s1 |
| InChIKey | InChI | 1.03 | FDUUQONQQWJTKJ-GSVOUGTGSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@H](SCC(O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](SCC(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C(C(=O)O)S[C@H](C(=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(C(=O)O)SC(C(=O)O)N |
