CAB
Summary
Name: | 4,4-dihydroxy-5-oxo-L-norvaline |
Formula: | C5 H9 N O5 |
Formal charge: | 0 |
Formula weight: | 163.129 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 4,4-dihydroxy-5-oxo-L-norvaline |
OpenEye OEToolkits | 1.7.0 | (2S)-2-azanyl-4,4-dihydroxy-5-oxo-pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=CC(O)(O)CC(C(=O)O)N |
SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CC(O)(O)C=O)C(O)=O |
SMILES | CACTVS | 3.370 | N[CH](CC(O)(O)C=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C([C@@H](C(=O)O)N)C(C=O)(O)O |
SMILES | OpenEye OEToolkits | 1.7.0 | C(C(C(=O)O)N)C(C=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C5H9NO5/c6-3(4(8)9)1-5(10,11)2-7/h2-3,10-11H,1,6H2,(H,8,9)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | NKTBKFGHLWDKLW-VKHMYHEASA-N |