Adarotene

CAS Registry Number®

496868-77-0

CAS Name

Adarotene

Molecular Formula

C25H26O3

Molecular Mass

374.47

Cite this Page

Adarotene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=496868-77-0 (retrieved 2024-11-22) (CAS RN: 496868-77-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >240 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H26O3/c26-23-7-6-21(20-4-1-16(2-5-20)3-8-24(27)28)12-22(23)25-13-17-9-18(14-25)11-19(10-17)15-25/h1-8,12,17-19,26H,9-11,13-15H2,(H,27,28)/b8-3+

InChIKey

InChIKey=QAWBIEIZDDIEMW-FPYGCLRLSA-N

SMILES

OC=1C(C23CC4CC(C2)CC(C3)C4)=CC(=CC1)C5=CC=C(/C=C/C(O)=O)C=C5

Canonical SMILES

O=C(O)C=CC=1C=CC(=CC1)C2=CC=C(O)C(=C2)C34CC5CC(CC(C5)C3)C4

Other Names for this Substance

  • 2-Propenoic acid, 3-(4′-hydroxy-3′-tricyclo[3.3.1.13,7]dec-1-yl[1,1′-biphenyl]-4-yl)-, (2E)-
  • (2E)-3-(4′-Hydroxy-3′-tricyclo[3.3.1.13,7]dec-1-yl[1,1′-biphenyl]-4-yl)-2-propenoic acid
  • ST 1926
  • Adarotene

CAS INSIGHTSTM
Targeted protein degrader structure, illustration