RefMet Compound Details
MW structure | 37315 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Desmosine | |
Systematic name | 2-amino-6-[4-[(4S)-4-amino-4-carboxybutyl]-3,5-bis[(3S)-3-amino-3-carboxypropyl]pyridin-1-ium-1-yl]hexanoic acid | |
SMILES | C(CC[n+]1cc(CC[C@@H](C(=O)O)N)c(CCC[C@@H](C(=O)O)N)c(CC[C@@H](C(=O)O)N)c1)CC(C(=O)O)N Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 526.287690 (neutral) |