(2E)-1-[3-[(1R,5R,6S)-6-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-2-propen-1-one

CAS Registry Number®

89803-84-9

CAS Name

(2E)-1-[3-[(1R,5R,6S)-6-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-2-propen-1-one

Molecular Formula

C40H38O8

Molecular Mass

646.72

Cite this Page

(2E)-1-[3-[(1R,5R,6S)-6-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-2-propen-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=89803-84-9 (retrieved 2024-11-22) (CAS RN: 89803-84-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C40H38O8/c1-22(2)4-14-28-34(44)18-16-30(38(28)46)40(48)36-31(25-8-12-27(42)13-9-25)20-23(3)21-32(36)37-35(45)19-15-29(39(37)47)33(43)17-7-24-5-10-26(41)11-6-24/h4-13,15-19,21,31-32,36,41-42,44-47H,14,20H2,1-3H3/b17-7+/t31-,32+,36-/m0/s1

InChIKey

InChIKey=SUQUIVSLHDOSQP-QSYQOTCISA-N

SMILES

C(=O)([C@@H]1[C@@H](C=C(C)C[C@H]1C2=CC=C(O)C=C2)C3=C(O)C(C(/C=C/C4=CC=C(O)C=C4)=O)=CC=C3O)C5=C(O)C(CC=C(C)C)=C(O)C=C5

Canonical SMILES

O=C(C=CC1=CC=C(O)C=C1)C2=CC=C(O)C(=C2O)C3C=C(C)CC(C4=CC=C(O)C=C4)C3C(=O)C5=CC=C(O)C(=C5O)CC=C(C)C

Other Names for this Substance

  • 2-Propen-1-one, 1-[3-[(1R,5R,6S)-6-[2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-, (2E)-
  • 2-Propen-1-one, 1-[3-[6-[2,4-dihydroxy-3-(3-methyl-2-butenyl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-, [1R-[1α(E),5β,6α]]-
  • 2-Propen-1-one, 1-[3-[(1R,5R,6S)-6-[2,4-dihydroxy-3-(3-methyl-2-butenyl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-, (2E)-
  • (2E)-1-[3-[(1R,5R,6S)-6-[2,4-Dihydroxy-3-(3-methyl-2-buten-1-yl)benzoyl]-5-(4-hydroxyphenyl)-3-methyl-2-cyclohexen-1-yl]-2,4-dihydroxyphenyl]-3-(4-hydroxyphenyl)-2-propen-1-one
  • (+)-Kuwanon V

View All

CAS INSIGHTSTM
Targeted protein degrader structure, illustration