RefMet Compound Details
MW structure | 70477 (View MW Metabolite Database details) | |
---|---|---|
RefMet name | Oligomycin A | |
Systematic name | (1R,4S,5E,5'R,6'R,7E,10S,11R,12S,14R,15S,16S,18R,19S,20R,21E,25S,26R,27S,29S)-4-ethyl-11,12,15,19-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',10,12,14,16,18,20,26,29-nonamethyl-spiro[24,28-dioxabicyclo[23.3.1]nonacosa-5,7,21-triene-27,2'-tetrahydropyran]-13,17,23-trione | |
SMILES | CC[C@H]1/C=C/C=C/C[C@@H](C)[C@@H]([C@](C)(C(=O)[C@@H](C)[C@@H]([C@@H](C)C(=O)[C@@H](C)[C@@H]([C@@H](C)/C=C/C(=O)O[C@@H]2[C@H](C)[C@H](CC1)O[C@]1(CC[C@H](C)[C@H](C[C@@H](C)O)O1)[C@H]2C)O)O)O)O Run Tanimoto similarity search (with similarity coefficient >=0.6) | |
Exact mass | 790.523115 (neutral) |