U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H40O7S
Molecular Weight 532.689
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pleuromutilin 22-Tosylate

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)C4=CC=C(C)C=C4

InChI

InChIKey=FQRBUAGWWIZWRO-SKJCYMNFSA-N
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

HIDE SMILES / InChI

Approval Year

Name Type Language
Pleuromutilin 22-Tosylate
Common Name English
14-O-(p-Toluenesulfonyloxyacetyl)mutilin
Preferred Name English
22-O-Tosylpleuromutilin
Common Name English
Acetic acid, [[(4-methylphenyl)sulfonyl]oxy]-, 6-ethenyldecahydro-5-hydroxy-4,6,9,10-tetramethyl-1-oxo-3a,9-propano-3aH-cyclopentacycloocten-8-yl ester, [3aS-(3a?,4?,5?,6?,8?,9?,9a?,10S*)]-
Systematic Name English
Glycolic acid, 8-ester with octahydro-5,8-dihydroxy-4,6,9,10-tetramethyl-6-vinyl-3a,9-propano-3aH-cyclopentacycloocten-1(4H)-one, 2-p-toluenesulfonate
Systematic Name English
Pleuromutilin 22-O-tosylate
Common Name English
Acetic acid, 2-[[(4-methylphenyl)sulfonyl]oxy]-, (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
Systematic Name English
Acetic acid, [[(4-methylphenyl)sulfonyl]oxy]-, (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
Systematic Name English
Code System Code Type Description
CAS
31716-01-5
Created by admin on Wed Apr 02 17:09:52 GMT 2025 , Edited by admin on Wed Apr 02 17:09:52 GMT 2025
PRIMARY
FDA UNII
VDG55W2XMF
Created by admin on Wed Apr 02 17:09:52 GMT 2025 , Edited by admin on Wed Apr 02 17:09:52 GMT 2025
PRIMARY
PUBCHEM
15546656
Created by admin on Wed Apr 02 17:09:52 GMT 2025 , Edited by admin on Wed Apr 02 17:09:52 GMT 2025
PRIMARY