Surgumycin
14,16,18,20,22,25,26,28,30-nonahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11-pentaen-2-one
Also Known As: Surgumycin|Sugimycin|Sugin|LIA-0166|28-hydro-23-dehydroxy-24,29-dihydroxyflavofungin|14,16,18,20,22,25,26,28,30-nonahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11-pentaen-2-one|14,16,18,20,22,25,26,28,30-Nonahydroxy-15,31-dimethyl-32-(propan-2-yl)-1-oxacyclodotriaconta-3,5,7,9,11-pentaen-2-one
| Molecular Formula | C36H60O11 |
|---|---|
| Molecular Weight | 668.4136 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 1 |
| Exact Mass | 668.4136 |
| Monoisotopic Mass | 668.4136 |
| Heavy Atoms | 47 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 51938-50-2 |
|---|---|
| SMILES | CC1C(CC=CC=CC=CC=CC=CC(=O)OC(C(C(CC(CC(C(CCC(CC(CC(CC1O)O)O)O)O)O)O)O)C)C(C)C)O |
| InChIKey | BFUTYTCDHCOXGG-UHFFFAOYSA-N |
Product Overview
Surgumycin (CAS 51938-50-2), with molecular formula C36H60O11 and molecular weight 668.4136 g/mol. IUPAC: 14,16,18,20,22,25,26,28,30-nonahydroxy-15,31-dimethyl-32-propan-2-yl-1-oxacyclodotriaconta-3,5,7,9,11-pentaen-2-one.
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