Obsolete: SOC
Summary
Name: | DIOXYSELENOCYSTEINE |
Formula: | C3 H7 N O4 Se |
Formal charge: | 0 |
Formula weight: | 200.052 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 3-(dioxidoselanyl)-L-alanine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)C[SeH](=O)=O |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](C[SeH](=O)=O)C(O)=O |
SMILES | CACTVS | 3.341 | N[CH](C[SeH](=O)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C([C@@H](C(=O)O)N)[SeH](=O)=O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(C(C(=O)O)N)[SeH](=O)=O |
InChI | InChI | 1.03 | InChI=1S/C3H7NO4Se/c4-2(3(5)6)1-9(7)8/h2,9H,1,4H2,(H,5,6)/t2-/m0/s1 |
InChIKey | InChI | 1.03 | LQMXQNUAKTVFAG-REOHCLBHSA-N |