SE7
2-AMINO-3-SELENINO-PROPIONIC ACID
Created: | 2013-12-19 |
Last modified: | 2024-09-27 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 16 |
Chiral Atom Count | 1 |
Bond Count | 15 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
---|---|
Name | 2-AMINO-3-SELENINO-PROPIONIC ACID |
Systematic Name (OpenEye OEToolkits) | (2R)-2-azanyl-3-selenino-propanoic acid |
Formula | C3 H7 N O4 Se |
Molecular Weight | 200.052 |
Type | L-PEPTIDE LINKING |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)C(N)C[Se](=O)O |
SMILES | CACTVS | 3.385 | N[CH](C[Se](O)=O)C(O)=O |
SMILES | OpenEye OEToolkits | 1.7.6 | C(C(C(=O)O)N)[Se](=O)O |
Canonical SMILES | CACTVS | 3.385 | N[C@@H](C[Se](O)=O)C(O)=O |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | C([C@@H](C(=O)O)N)[Se](=O)O |
InChI | InChI | 1.03 | InChI=1S/C3H7NO4Se/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8)/t2-/m0/s1 |
InChIKey | InChI | 1.03 | CNQFMZMZJWKKEH-REOHCLBHSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 49787005 |
ChEBI | CHEBI:28454 |