RefMet Compound Details
MW structure | 22669 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Pachyrrhizone | |
Systematic name | (1S,13S)-16-methoxy-5,7,11,14,18-pentaoxahexacyclo[11.11.0.02,10.04,8.015,23.017,21]tetracosa-2,4(8),9,15(23),16,19,21-heptaen-24-one | |
SMILES | COc1c2c(cco2)cc2C(=O)[C@H]3c4cc5c(cc4OC[C@H]3Oc12)OCO5 Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 366.073955 (neutral) |