Methyl (2E,3E,5E)-6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-buten-1-yl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-3,5-hexadienoate

CAS Registry Number®

113489-65-9

CAS Name

Methyl (2E,3E,5E)-6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-buten-1-yl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-3,5-hexadienoate

Molecular Formula

C26H34O7

Molecular Mass

458.54

Cite this Page

Methyl (2E,3E,5E)-6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-buten-1-yl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-3,5-hexadienoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113489-65-9 (retrieved 2024-11-22) (CAS RN: 113489-65-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H34O7/c1-18(2)12-13-31-24-17-32-22-11-10-19(14-23(22)33-26(24,3)4)8-7-9-20(15-27)21(16-29-5)25(28)30-6/h7-12,14,16,24,27H,13,15,17H2,1-6H3/b8-7+,20-9-,21-16+/t24-/m0/s1

InChIKey

InChIKey=NONWIHHDNSSAAO-OKYDWORPSA-N

SMILES

C(=C/C=C(\C(\C(OC)=O)=C/OC)/CO)\C=1C=C2C(OC[C@H](OCC=C(C)C)C(C)(C)O2)=CC1

Canonical SMILES

O=C(OC)C(=COC)C(=CC=CC1=CC=C2OCC(OCC=C(C)C)C(OC2=C1)(C)C)CO

Other Names for this Substance

  • 3,5-Hexadienoic acid, 6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-buten-1-yl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-, methyl ester, (2E,3E,5E)-
  • 3,5-Hexadienoic acid, 6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-butenyl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-, methyl ester, (3E,5E)-
  • 3,5-Hexadienoic acid, 6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-butenyl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-, methyl ester, (2E,3E,5E)-
  • Methyl (2E,3E,5E)-6-[(3S)-3,4-dihydro-4,4-dimethyl-3-[(3-methyl-2-buten-1-yl)oxy]-2H-1,5-benzodioxepin-7-yl]-3-(hydroxymethyl)-2-(methoxymethylene)-3,5-hexadienoate
  • Hydroxystrobilurin D

Deleted or Replaced CAS Registry Numbers

199173-59-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration