SEE
Summary
Name: | trihydroxy(L-serinato-kappaO~3~)borate(1-) |
Formula: | C3 H9 B N O6 |
Formal charge: | -1 |
Formula weight: | 165.918 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | trihydroxy(L-serinato-kappaO~3~)borate(1-) |
OpenEye OEToolkits | 1.5.0 | [(2S)-2-amino-3-hydroxy-3-oxo-propoxy]-trihydroxy-boron |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(N)CO[B-](O)(O)O |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CO[B-](O)(O)O)C(O)=O |
SMILES | CACTVS | 3.341 | N[CH](CO[B-](O)(O)O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [B-](O)(O)(O)OC[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | [B-](O)(O)(O)OCC(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C3H9BNO6/c5-2(3(6)7)1-11-4(8,9)10/h2,8-10H,1,5H2,(H,6,7)/q-1/t2-/m0/s1 |
InChIKey | InChI | 1.03 | IVIUHRYRMDVYGR-REOHCLBHSA-N |