DO2
Summary
Name: | 5,5-dihydroxy-6-oxo-L-norleucine |
Formula: | C6 H11 N O5 |
Formal charge: | 0 |
Formula weight: | 177.155 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 5,5-dihydroxy-6-oxo-L-norleucine |
OpenEye OEToolkits | 1.7.0 | (2S)-2-azanyl-5,5-dihydroxy-6-oxo-hexanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=CC(O)(O)CCC(N)C(=O)O |
SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CCC(O)(O)C=O)C(O)=O |
SMILES | CACTVS | 3.370 | N[CH](CCC(O)(O)C=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CC(C=O)(O)O)[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.7.0 | C(CC(C=O)(O)O)C(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C6H11NO5/c7-4(5(9)10)1-2-6(11,12)3-8/h3-4,11-12H,1-2,7H2,(H,9,10)/t4-/m0/s1 |
InChIKey | InChI | 1.03 | GRXWCZHHLRJOLV-BYPYZUCNSA-N |