RefMet Compound Details
MW structure | 70201 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Undulatone | |
Systematic name | methyl (Z)-dec-2-en-4,6,8-triynoate | |
SMILES | C/C=C(\C)/C(=O)O[C@@H]1[C@H]2C(=CC(=O)[C@H]([C@]2(C)[C@@H]2[C@]34CO[C@]2([C@@H]([C@H](C)[C@@H]3[C@H](C(=O)O[C@H]14)OC(=O)C)O)O)O)C Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 534.210115 (neutral) |