Name | Lefamulin acetate |
Iupac Chemical Name | Acetate salt of (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-ethenyl-5-hydroxy-4,6,9,10-tetramethyl-1-oxodecahydro-3a,9-propano-3aH-cyclopenta(8)annulen-8-yl {((1R,2R,4R)-4-amino-2-hydroxycyclohexyl)sulfanyl}acetate ester |
Synonyms | BC-3781.Ac |
Molecular Formula | C30H49NO7S |
Molecular Weight | 567.778 |
Smile | CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)CSC4CCC(CC4O)N)C.CC(=O)O |
InChiKey | WSMXIQXWHPSVDE-UHFFFAOYSA-N |
InChi | InChI=1S/C28H45NO5S.C2H4O2/c1-6-26(4)14-22(34-23(32)15-35-21-8-7-18(29)13-20(21)31)27(5)16(2)9-11-28(17(3)25(26)33)12-10-19(30)24(27)28;1-2(3)4/h6,16-18,20-22,24-25,31,33H,1,7-15,29H2,2-5H3;1H3,(H,3,4) |
CAS Number | 1350636-82-6 |
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