RefMet Compound Details
MW structure | 37314 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Deoxypyridinoline | |
Systematic name | 4-[(2S)-2-amino-2-carboxyethyl]-3-[(3S)-3-amino-3-carboxylatopropyl]-1-[(5S)-5-amino-5-carboxypentyl]-5-hydroxypyridin-1-ium | |
SMILES | C(CC[n+]1cc(CC[C@@H](C(=O)[O-])N)c(C[C@@H](C(=O)O)N)c(c1)O)C[C@@H](C(=O)O)N Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 412.195799 (neutral) |