RefMet Compound Details
MW structure | 35023 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | 16:0-Glc-Sitosterol | |
Systematic name | 3-O-(6'-O-hexadecanoyl-beta-D-glucopyranosyl)-stigmast-5-en-3beta-ol | |
SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O[C@H]2CC[C@@]3(C)C(=CC[C@H]4[C@@H]5CC[C@H]([C@H](C)CC[C@@H](CC)C(C)C)[C@@]5(C)CC[C@H]34)C2)O1)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 814.668657 (neutral) |