Analyte Name

Pleuromutilin 22-Tosylate

CAS Number

31716-01-5

Molecular Formula

C29 H40 O7 S

Molecular Weight

532.69

Accurate Mass

532.2495

SMILES

C[C@@H]1CC[C@@]23CCC(=O)[C@H]2[C@]1(C)[C@@H](C[C@@](C)(C=C)[C@@H](O)[C@@H]3C)OC(=O)COS(=O)(=O)c4ccc(C)cc4

InChI

InChI=1S/C29H40O7S/c1-7-27(5)16-23(36-24(31)17-35-37(33,34)21-10-8-18(2)9-11-21)28(6)19(3)12-14-29(20(4)26(27)32)15-13-22(30)25(28)29/h7-11,19-20,23,25-26,32H,1,12-17H2,2-6H3/t19-,20+,23-,25+,26+,27-,28+,29+/m1/s1

IUPAC

2-[[(4-Methylphenyl)sulfonyl]oxy]acetic acid (3aS,4R,5S,6S,8R,9R,9aR,10R)-6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-yl ester

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat

API Family

Tiamulin Hydrogen Fumarate