5,7-Dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium

CAS Registry Number®

339080-03-4

CAS Name

5,7-Dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium

Molecular Formula

C30H27O14

Cite this Page

5,7-Dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=339080-03-4 (retrieved 2024-11-22) (CAS RN: 339080-03-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H26O14/c31-15-4-1-13(2-5-15)3-6-24(36)41-12-23-26(38)27(39)28(40)30(44-23)43-22-11-17-18(33)9-16(32)10-21(17)42-29(22)14-7-19(34)25(37)20(35)8-14/h1-11,23,26-28,30,38-40H,12H2,(H5-,31,32,33,34,35,36,37)/p+1/t23-,26+,27+,28-,30-/m1/s1

InChIKey

InChIKey=DHTPVCYNNWQRMN-SANVHKNKSA-O

SMILES

O(C=1C(=[O+]C2=C(C1)C(O)=CC(O)=C2)C3=CC(O)=C(O)C(O)=C3)[C@@H]4O[C@H](COC(/C=C/C5=CC=C(O)C=C5)=O)[C@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C(OCC1OC(OC2=CC=3C(O)=CC(O)=CC3[O+]=C2C=4C=C(O)C(O)=C(O)C4)C(O)C(O)C1O)C=CC5=CC=C(O)C=C5

Other Names for this Substance

  • 1-Benzopyrylium, 5,7-dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-
  • 1-Benzopyrylium, 5,7-dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-
  • 5,7-Dihydroxy-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-galactopyranosyl]oxy]-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium

CAS INSIGHTSTM
Targeted protein degrader structure, illustration