VI3
Summary
| Name: | (2~{R})-2-azanyl-3-[bis(oxidanylidene)-$l^{5}-sulfanyl]propanoic acid |
| Formula: | C3 H6 N O4 S |
| Formal charge: | -1 |
| Formula weight: | 152.149 Da |
| Component type: | L-peptide linking |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-azanyl-3-sulfinato-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C3H6NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)/q-1/t2-/m0/s1 |
| InChIKey | InChI | 1.06 | RRLRIWQWKHHDRA-REOHCLBHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[C@@H](C[S-](=O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | N[CH](C[S-](=O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C([C@@H](C(=O)O)N)[S-](=O)=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C(C(C(=O)O)N)[S-](=O)=O |
