Dexamethasone β-D-glucuronide

CAS Registry Number®

152154-28-4
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CAS Name

Dexamethasone β-D-glucuronide

Molecular Formula

C28H37FO11

Molecular Mass

568.59

Cite this Page

Dexamethasone β-D-glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=152154-28-4 (retrieved 2024-04-28) (CAS RN: 152154-28-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H37FO11/c1-12-8-16-15-5-4-13-9-14(30)6-7-25(13,2)27(15,29)17(31)10-26(16,3)28(12,38)18(32)11-39-24-21(35)19(33)20(34)22(40-24)23(36)37/h6-7,9,12,15-17,19-22,24,31,33-35,38H,4-5,8,10-11H2,1-3H3,(H,36,37)/t12-,15+,16+,17+,19+,20+,21-,22+,24-,25+,26+,27+,28+/m1/s1

InChIKey

InChIKey=UBHXMSIBGRGDSX-VFGCUDCLSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](F)([C@]4(C)C(CC3)=CC(=O)C=C4)[C@@H](O)C1)[H])(C[C@@H](C)[C@@]2(C(CO[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)=O)O)[H]

Canonical SMILES

O=C(O)C1OC(OCC(=O)C2(O)C(C)CC3C4CCC5=CC(=O)C=CC5(C)C4(F)C(O)CC32C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, (11β,16α)-9-fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl
  • (11β,16α)-9-Fluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl β-D-glucopyranosiduronic acid
  • Dexamethasone β-D-glucuronide

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