RefMet Compound Details
MW structure | 68475 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Cercosporin | |
Systematic name | 7,19-dihydroxy-5,21-bis[(2S)-2-hydroxypropyl]-6,20-dimethoxy-12,14-dioxahexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1(15),2(11),3(8),4(22),5,7,10,18(23),19-nonaene-9,17-dione | |
SMILES | C[C@@H](Cc1c2c3c(C[C@H](C)O)c(c(c4C(=O)C=C5c(c6C(=CC(=O)c(c26)c(c1OC)O)OCO5)c34)O)OC)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 534.152600 (neutral) |