β-D-Glucopyranose, cyclic 4→2′:6→2-[(1S)-5-(6-carboxy-2,3,4-trihydroxyphenoxy)-4,4′,5′,6,6′-pentahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1,2,3-tris(3,4,5-trihydroxybenzoate)

CAS Registry Number®

185424-92-4

CAS Name

β-D-Glucopyranose, cyclic 4→2′:6→2-[(1S)-5-(6-carboxy-2,3,4-trihydroxyphenoxy)-4,4′,5′,6,6′-pentahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1,2,3-tris(3,4,5-trihydroxybenzoate)

Molecular Formula

C48H34O31

Molecular Mass

1106.77

Cite this Page

β-D-Glucopyranose, cyclic 4→2′:6→2-[(1S)-5-(6-carboxy-2,3,4-trihydroxyphenoxy)-4,4′,5′,6,6′-pentahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1,2,3-tris(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=185424-92-4 (retrieved 2024-11-22) (CAS RN: 185424-92-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C48H34O31/c49-17-1-11(2-18(50)29(17)58)43(68)77-40-39-26(74-48(79-45(70)13-5-21(53)31(60)22(54)6-13)41(40)78-44(69)12-3-19(51)30(59)20(52)4-12)10-73-46(71)14-8-25(57)38(75-37-16(42(66)67)9-24(56)33(62)36(37)65)35(64)28(14)27-15(47(72)76-39)7-23(55)32(61)34(27)63/h1-9,26,39-41,48-65H,10H2,(H,66,67)

InChIKey

InChIKey=HYXQWPAKDBAJLB-UHFFFAOYSA-N

SMILES

O(C(=O)C1=CC(O)=C(O)C(O)=C1)C2C3C(OC(OC(=O)C4=CC(O)=C(O)C(O)=C4)C2OC(=O)C5=CC(O)=C(O)C(O)=C5)COC(=O)C=6C(C=7C(C(=O)O3)=CC(O)=C(O)C7O)=C(O)C(OC8=C(C(O)=O)C=C(O)C(O)=C8O)=C(O)C6

Canonical SMILES

O=C(O)C1=CC(O)=C(O)C(O)=C1OC2=C(O)C=C3C(=O)OCC4OC(OC(=O)C5=CC(O)=C(O)C(O)=C5)C(OC(=O)C6=CC(O)=C(O)C(O)=C6)C(OC(=O)C7=CC(O)=C(O)C(O)=C7)C4OC(=O)C=8C=C(O)C(O)=C(O)C8C3=C2O

Other Names for this Substance

  • β-D-Glucopyranose, cyclic 4→2′:6→2-[(1S)-5-(6-carboxy-2,3,4-trihydroxyphenoxy)-4,4′,5′,6,6′-pentahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1,2,3-tris(3,4,5-trihydroxybenzoate)
  • β-D-Glucopyranose, cyclic 4→2′:6→2-[(S)-5-(6-carboxy-2,3,4-trihydroxyphenoxy)-4,4′,5′,6,6′-pentahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1,2,3-tris(3,4,5-trihydroxybenzoate)
  • Syzyginin A

CAS INSIGHTSTM
Targeted protein degrader structure, illustration