GLK
Summary
Name: | (4S)-4-amino-5,5-dihydroxypentanoic acid |
Formula: | C5 H11 N O4 |
Formal charge: | 0 |
Formula weight: | 149.145 Da |
Component type: | peptide-like |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | (4S)-4-amino-5,5-dihydroxypentanoic acid |
OpenEye OEToolkits | 1.7.0 | (4S)-4-azanyl-5,5-dihydroxy-pentanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)CCC(N)C(O)O |
SMILES_CANONICAL | CACTVS | 3.370 | N[C@@H](CCC(O)=O)C(O)O |
SMILES | CACTVS | 3.370 | N[CH](CCC(O)=O)C(O)O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CC(=O)O)[C@@H](C(O)O)N |
SMILES | OpenEye OEToolkits | 1.7.0 | C(CC(=O)O)C(C(O)O)N |
InChI | InChI | 1.03 | InChI=1S/C5H11NO4/c6-3(5(9)10)1-2-4(7)8/h3,5,9-10H,1-2,6H2,(H,7,8)/t3-/m0/s1 |
InChIKey | InChI | 1.03 | MKADZLMZCPSMML-VKHMYHEASA-N |