Desacetyldoronine

CAS Registry Number®

120481-77-8

CAS Name

Desacetyldoronine

Molecular Formula

C19H28ClNO7

Molecular Mass

417.88

Cite this Page

Desacetyldoronine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=120481-77-8 (retrieved 2024-11-22) (CAS RN: 120481-77-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C19H28ClNO7/c1-11-9-19(26,12(2)20)17(24)28-14-6-8-21(4)7-5-13(15(14)22)10-27-16(23)18(11,3)25/h5,11-12,14,25-26H,6-10H2,1-4H3

InChIKey

InChIKey=OMHSMPLRLNEBIB-UHFFFAOYSA-N

SMILES

O=C1C2OC(=O)C(C(C)Cl)(O)CC(C)C(C)(O)C(=O)OCC1=CCN(C)CC2

Canonical SMILES

O=C1OCC2=CCN(C)CCC(OC(=O)C(O)(CC(C)C1(O)C)C(Cl)C)C2=O

Other Names for this Substance

  • 2,9-Dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione, 4-[(1R)-1-chloroethyl]-4,7-dihydroxy-6,7,14-trimethyl-, (1R,4S,6R,7R)-
  • 4,8-Secosenecionan-8,11,16-trione, 20-chloro-15,20-dihydro-12,15-dihydroxy-4-methyl-, (15α,20R)-
  • (1R,4S,6R,7R)-4-[(1R)-1-Chloroethyl]-4,7-dihydroxy-6,7,14-trimethyl-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-ene-3,8,17-trione
  • Desacetyldoronine
  • O-Deacetyldoronine

CAS INSIGHTSTM
Targeted protein degrader structure, illustration