2-(β-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione

CAS Registry Number®

96820-54-1
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CAS Name

2-(β-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione

Molecular Formula

C25H28O12

Molecular Mass

520.48

Cite this Page

2-(β-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=96820-54-1 (retrieved 2024-09-19) (CAS RN: 96820-54-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C25H28O12/c1-9-6-10-14(18(29)15-11(16(10)27)7-12(32-2)22(33-3)24(15)35-5)23(34-4)21(9)37-25-20(31)19(30)17(28)13(8-26)36-25/h6-7,13,17,19-20,25-26,28,30-31H,8H2,1-5H3/t13-,17-,19+,20-,25+/m1/s1

InChIKey

InChIKey=QBFJCZWBSLFTEE-UWBHIVAPSA-N

SMILES

O(C)C1=C2C(C(=O)C=3C(C2=O)=C(OC)C(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C(C)C3)=CC(OC)=C1OC

Canonical SMILES

O=C1C2=CC(OC)=C(OC)C(OC)=C2C(=O)C=3C(OC)=C(OC4OC(CO)C(O)C(O)C4O)C(=CC13)C

Other Names for this Substance

  • 9,10-Anthracenedione, 2-(β-D-glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-
  • 2-(β-D-Glucopyranosyloxy)-1,6,7,8-tetramethoxy-3-methyl-9,10-anthracenedione
  • Chrysoobtusin 2-β-D-glucoside