LLY
Summary
Name: | NZ-(DICARBOXYMETHYL)LYSINE |
Formula: | C9 H16 N2 O6 |
Formal charge: | 0 |
Formula weight: | 248.233 Da |
Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | {[(5S)-5-amino-5-carboxypentyl]amino}propanedioic acid |
OpenEye OEToolkits | 1.5.0 | 2-[[(5S)-5-amino-6-hydroxy-6-oxo-hexyl]amino]propanedioic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)C(C(=O)O)NCCCCC(N)C(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | N[C@@H](CCCCNC(C(O)=O)C(O)=O)C(O)=O |
SMILES | CACTVS | 3.341 | N[CH](CCCCNC(C(O)=O)C(O)=O)C(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CCNC(C(=O)O)C(=O)O)C[C@@H](C(=O)O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CCNC(C(=O)O)C(=O)O)CC(C(=O)O)N |
InChI | InChI | 1.03 | InChI=1S/C9H16N2O6/c10-5(7(12)13)3-1-2-4-11-6(8(14)15)9(16)17/h5-6,11H,1-4,10H2,(H,12,13)(H,14,15)(H,16,17)/t5-/m0/s1 |
InChIKey | InChI | 1.03 | XINFXVVRMYBFMI-YFKPBYRVSA-N |