(5α,7α,13α)-7-(Acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-24-norchola-1,14,20,22-tetraene-3,16-dione

CAS Registry Number®

160669-70-5

CAS Name

(5α,7α,13α)-7-(Acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-24-norchola-1,14,20,22-tetraene-3,16-dione

Molecular Formula

C28H34O6

Molecular Mass

466.57

Cite this Page

(5α,7α,13α)-7-(Acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-24-norchola-1,14,20,22-tetraene-3,16-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=160669-70-5 (retrieved 2024-11-22) (CAS RN: 160669-70-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H34O6/c1-16(29)34-23-14-19-24(2,3)21(30)8-10-25(19,4)18-7-11-26(5)20(27(18,23)6)13-22(31)28(26,32)17-9-12-33-15-17/h8-10,12-13,15,18-19,23,32H,7,11,14H2,1-6H3/t18-,19+,23-,25-,26-,27-,28-/m1/s1

InChIKey

InChIKey=QXKHBVSTPRHRQV-CMBOGFGBSA-N

SMILES

C[C@]12C=3[C@](C)([C@](O)(C(=O)C3)C=4C=COC4)CC[C@@]1([C@]5(C)[C@@](C[C@H]2OC(C)=O)(C(C)(C)C(=O)C=C5)[H])[H]

Canonical SMILES

O=C(OC1CC2C(C=CC(=O)C2(C)C)(C)C3CCC4(C(=CC(=O)C4(O)C5=COC=C5)C13C)C)C

Other Names for this Substance

  • 24-Norchola-1,14,20,22-tetraene-3,16-dione, 7-(acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-, (5α,7α,13α)-
  • (5α,7α,13α)-7-(Acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-24-norchola-1,14,20,22-tetraene-3,16-dione
  • 17-epi-17-Hydroxyazadiradione

CAS INSIGHTSTM
Targeted protein degrader structure, illustration