GHG
Summary
Name: | (2S,4S)-2,5-diamino-4-hydroxy-5-oxopentanoic acid (non-preferred name) |
Formula: | C5 H10 N2 O4 |
Formal charge: | 0 |
Formula weight: | 162.144 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (2S,4S)-2,5-diamino-4-hydroxy-5-oxopentanoic acid (non-preferred name) |
OpenEye OEToolkits | 1.7.0 | (2S,4S)-2,5-bis(azanyl)-4-hydroxy-5-oxo-pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(N)C(O)CC(C(=O)O)N |
SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](C[C@H](O)C(N)=O)C(O)=O |
SMILES | CACTVS | 3.370 | N[CH](C[CH](O)C(N)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C([C@@H](C(=O)O)N)[C@@H](C(=O)N)O |
SMILES | OpenEye OEToolkits | 1.7.0 | C(C(C(=O)O)N)C(C(=O)N)O |
InChI | InChI | 1.03 | InChI=1S/C5H10N2O4/c6-2(5(10)11)1-3(8)4(7)9/h2-3,8H,1,6H2,(H2,7,9)(H,10,11)/t2-,3-/m0/s1 |
InChIKey | InChI | 1.03 | VTJRNXQBJNWLRA-HRFVKAFMSA-N |