Chemical Compound

Dexamethasone-21-sulfobenzoate

CAS Registry Number 16978-57-7
Dexamethasone-21-sulfobenzoate chemical structure
Primary Record

Dexamethasone-21-sulfobenzoate

In stock
3,353 g
Purity
99.4 %
CAS
16978-57-7

Compound Identifiers & Properties

CAS
16978-57-7
PubChem CID
63046
SMILES
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)C5=CC(=CC=C5)S(=O)(=O)O)O)C)O)F)C
Canonical SMILES
C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)c1cccc(S(=O)(=O)O)c1

Names & Synonyms

  • Dexamethasone-21-sulfobenzoate
  • dexamethasone metasulfobenzoate
  • Dexamethasone m-sulfobenzoate
  • RefChem:905629
  • UNII-C67221CB9Q
  • AC1L1Y9M
  • C67221CB9Q
  • DTXSID9048308
  • 21-(3-Sulfobenzoyl)dexamethasone
  • C29H33FO9S
  • DDS-21
  • SCHEMBL9562205
  • CHEMBL3305965
  • DTXCID1028283
  • EINECS 241-057-3
  • TWQWRHIQRAZHPR-XNXCGYEVSA-N
  • CID63046
  • ZINC4212887
  • C29-H33-F-O9-S
  • EBC-27342
  • DB14703
  • Dexamethasone 21-(sodium 3-sulphobenzoate)
  • 16978-57-7
  • J318.314I
  • EN300-33389614
  • Q27275240
  • 3-({2-[(1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethoxy}carbonyl)benzene-1-sulfonic acid
  • (11beta,16alpha)-9-Fluoro-11,17-dihydroxy-16-methyl-21-((3-sulfobenzoyl)oxy)pregna-1,4-diene-3,20-dione
  • 241-057-3
  • 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
  • 3-[[(9-Fluoro-11beta,17-dihydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl)oxy]carbonyl]benzenesulfonic acid
  • 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
  • 3-{[(9-Fluoro-11beta,17-dihydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl)oxy]carbonyl}benzene-1-sulfonic acid
  • PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11,17-DIHYDROXY-16-METHYL-21-((3-SULFOBENZOYL)OXY)-, (11.BETA.,16.ALPHA.)-
  • Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-16-methyl-21-((3-sulfobenzoyl)oxy)-, (11beta,16alpha)-