RefMet Compound Details
MW structure | 27915 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Hypericin | |
Systematic name | 9,11,13,16,18,20-hexahydroxy-5,24-dimethyloctacyclo[13.11.1.12,10.03,8.04,25.019,27.021,26.014,28]octacosa-1(26),2,4(25),5,8,10,12,14(28),15(27),16,18,20,23-tridecaene-7,22-dione | |
SMILES | Cc1cc(c2c3c1c1c(C)cc(c4c1c1c5c(c(cc(c5C4=O)O)O)c4c(cc(c(c4c31)C2=O)O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 504.084520 (neutral) |