(11β,16α)-16,17-[Butylidenebis(oxy)]-11,21-dihydroxypregna-1,4,6-triene-3,20-dione

CAS Registry Number®

109458-75-5

CAS Name

(11β,16α)-16,17-[Butylidenebis(oxy)]-11,21-dihydroxypregna-1,4,6-triene-3,20-dione

Molecular Formula

C25H32O6

Molecular Mass

428.52

Cite this Page

(11β,16α)-16,17-[Butylidenebis(oxy)]-11,21-dihydroxypregna-1,4,6-triene-3,20-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=109458-75-5 (retrieved 2024-11-23) (CAS RN: 109458-75-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H32O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h6-10,16-18,20-22,26,28H,4-5,11-13H2,1-3H3/t16-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1

InChIKey

InChIKey=OFBFHEDLHIWDQX-KWVAZRHASA-N

SMILES

C(CO)(=O)[C@]12[C@]3(C)[C@@](C[C@]1(OC(CCC)O2)[H])([C@]4([C@]([C@@H](O)C3)([C@]5(C)C(C=C4)=CC(=O)C=C5)[H])[H])[H]

Canonical SMILES

O=C1C=CC2(C(C=CC3C4CC5OC(OC5(C(=O)CO)C4(C)CC(O)C32)CCC)=C1)C

Other Names for this Substance

  • Pregna-1,4,6-triene-3,20-dione, 16,17-[butylidenebis(oxy)]-11,21-dihydroxy-, (11β,16α)-
  • (11β,16α)-16,17-[Butylidenebis(oxy)]-11,21-dihydroxypregna-1,4,6-triene-3,20-dione
  • Δ6-Budesonide

CAS INSIGHTSTM
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