RefMet Compound Details
MW structure | 34417 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Cucurbitacin L | |
Systematic name | (8S,9R,10R,13R,14S,16R,17R)-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxoheptan-2-yl]-2,16-dihydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione | |
SMILES | CC(C)(CCC(=O)[C@@](C)([C@H]1[C@@H](C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(C(=O)C4(C)C)O)[C@]3(C)C(=O)C[C@]12C)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Sum Composition | ST 30:5;O7 | View other entries in RefMet with this sum composition |
Exact mass | 516.308705 (neutral) |