RefMet Compound Details
MW structure | 36661 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | 3-Oxochola-1,4,6-trien-24-oic acid | |
Systematic name | 3-Oxochola-1,4,6-trien-24-oic acid | |
SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C=CC4=CC(=O)C=C[C@]4(C)[C@H]3CC[C@]12C Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Sum Composition | ST 24:5;O3 | View other entries in RefMet with this sum composition |
Exact mass | 368.235146 (neutral) |