Oligomycin A, Streptomyces
(4E,5'R,6R,7S,8R,10R,11R,12S,14S,15R,16S,18E,20E,28R,29S)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethylspiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-oxane]-3,9,13-trione
Also Known As: Oligomycin|oligomycin A|Oligomycin A, Streptomyces|Oligomycin A, >=95% (HPLC)|SMP1_000225|SR-01000838303-3|BRD-A81541225-001-01-9|BRD-A81541225-001-06-8|(5E,5'R,7E,10S,11R,12S,14S,15R,16R,18R,19S,20R,21E,26R,29S)-4-ethyl-11,12,15,19-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',10,12,14,16,18,20,26,29-nonamethylspiro[24,28-dioxabicyclo[23.3.1]nonacosa-5,7,21-triene-27,2'-oxane]-13,17,23-trione
| Molecular Formula | C45H74O11 |
|---|---|
| Molecular Weight | 790.52313 g/mol |
| LogP | 5.8826 |
| Topological Polar Surface Area | 180.05 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 3 |
| Exact Mass | 790.52313 |
| Monoisotopic Mass | 790.52313 |
| Heavy Atoms | 56 |
| Complexity | 1387.4438 |
Chemical Identifiers
| CAS Number | 579-13-5 |
|---|---|
| SMILES | CCC\1CCC2[C@@H](C([C@H](C3(O2)CC[C@H](C(O3)C[C@H](C)O)C)C)OC(=O)/C=C/[C@H]([C@@H]([C@H](C(=O)[C@@H]([C@H]([C@@H](C(=O)[C@@]([C@@H]([C@H](C/C=C/C=C1)C)O)(C)O)C)O)C)C)O)C)C |
Product Overview
Oligomycin A, Streptomyces (CAS 579-13-5), with molecular formula C45H74O11 and molecular weight 790.52313 g/mol. IUPAC: (4E,5'R,6R,7S,8R,10R,11R,12S,14S,15R,16S,18E,20E,28R,29S)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2S)-2-hydroxypropyl]-5',6,8,10,12,14,16,28,29-nonamethylspiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-oxane]-3,9,13-trione.
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