4-[[2-[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]butanoic acid

CAS Registry Number®

256382-23-7

CAS Name

4-[[2-[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]butanoic acid

Molecular Formula

C23H32O6S

Molecular Mass

436.56

Cite this Page

4-[[2-[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=256382-23-7 (retrieved 2024-11-22) (CAS RN: 256382-23-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H32O6S/c1-29-15-17-5-2-4-16(12-17)13-18(24)7-8-19-20(22(26)14-21(19)25)9-11-30-10-3-6-23(27)28/h2,4-5,7-8,12,18-21,24-25H,3,6,9-11,13-15H2,1H3,(H,27,28)/b8-7+/t18-,19-,20-,21-/m1/s1

InChIKey

InChIKey=ORSJUPRAHPZYRL-XHTUOEPPSA-N

SMILES

C(=C/[C@H](CC1=CC(COC)=CC=C1)O)\[C@@H]2[C@@H](CCSCCCC(O)=O)C(=O)C[C@H]2O

Canonical SMILES

O=C(O)CCCSCCC1C(=O)CC(O)C1C=CC(O)CC=2C=CC=C(C2)COC

Other Names for this Substance

  • Butanoic acid, 4-[[2-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]-
  • Butanoic acid, 4-[[2-[(1R,2R,3R)-3-hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-butenyl]-5-oxocyclopentyl]ethyl]thio]-
  • 4-[[2-[(1R,2R,3R)-3-Hydroxy-2-[(1E,3S)-3-hydroxy-4-[3-(methoxymethyl)phenyl]-1-buten-1-yl]-5-oxocyclopentyl]ethyl]thio]butanoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration