Identification Common Name Dexamethazone metasulfobenzoate sodium Class Small Molecule Description Contaminant Sources ToxCast & Tox21 Chemicals Contaminant Type Not Available Chemical Structure Synonyms Value Source Dexamethasone metasulfobenzoate sodium ChEBI Dexamethasone sodium-m-sulfobenzoate ChEBI Dexamethasone-21-sulphobenzoate sodium ChEBI Dexamethazone metasulfobenzoate sodium ChEBI Dexapos ChEBI Santeson ChEBI Dexamethasone metasulfobenzoic acid sodium Generator Dexamethasone metasulphobenzoate sodium Generator Dexamethasone metasulphobenzoic acid sodium Generator Dexamethasone sodium-m-sulfobenzoic acid Generator Dexamethasone sodium-m-sulphobenzoate Generator Dexamethasone sodium-m-sulphobenzoic acid Generator Dexamethasone-21-sulfobenzoate sodium Generator Dexamethasone-21-sulfobenzoic acid sodium Generator Dexamethasone-21-sulphobenzoic acid sodium Generator Dexamethazone metasulfobenzoic acid sodium Generator Dexamethazone metasulphobenzoate sodium Generator Dexamethazone metasulphobenzoic acid sodium Generator Dexamethasone sodium m-sulfobenzoic acid Generator Dexamethasone sodium m-sulphobenzoate Generator Dexamethasone sodium m-sulphobenzoic acid Generator Sodium;3-[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonylbenzenesulfonic acid Generator Sodium;3-[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonylbenzenesulphonate Generator Sodium;3-[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonylbenzenesulphonic acid Generator
Chemical Formula C29 H32 FNaO9 S Average Molecular Mass 598.610 g/mol Monoisotopic Mass 598.165 g/mol CAS Registry Number 3936-02-5 IUPAC Name sodium 3-({2-[(1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dihydroxy-2,13,15-trimethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-14-yl]-2-oxoethoxy}carbonyl)benzene-1-sulfonate Traditional Name sodium 3-({2-[(1R,2S,10S,11S,13R,14R,15S,17S)-1-fluoro-14,17-dihydroxy-2,13,15-trimethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-14-yl]-2-oxoethoxy}carbonyl)benzenesulfonate SMILES [Na+].[H][C@@]1(C)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@]([H])(O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C1=CC(=CC=C1)S([O-])(=O)=O InChI Identifier InChI=1S/C29H33FO9S.Na/c1-16-11-22-21-8-7-18-13-19(31)9-10-26(18,2)28(21,30)23(32)14-27(22,3)29(16,35)24(33)15-39-25(34)17-5-4-6-20(12-17)40(36,37)38;/h4-6,9-10,12-13,16,21-23,32,35H,7-8,11,14-15H2,1-3H3,(H,36,37,38);/q;+1/p-1/t16-,21+,22+,23+,26+,27+,28+,29+;/m1./s1 InChI Key RPBJOYICBFNIMN-RDWMNNCQSA-M 
