1-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-8-hydroxy-3-methoxy-6-methyl-9,10-anthracenedione

CAS Registry Number®

84268-38-2
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CAS Name

1-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-8-hydroxy-3-methoxy-6-methyl-9,10-anthracenedione

Molecular Formula

C28H32O15

Molecular Mass

608.54

Cite this Page

1-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-8-hydroxy-3-methoxy-6-methyl-9,10-anthracenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=84268-38-2 (retrieved 2024-09-19) (CAS RN: 84268-38-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H32O15/c1-9-3-11-17(13(30)4-9)22(34)18-12(19(11)31)5-10(39-2)6-14(18)41-28-26(38)24(36)21(33)16(43-28)8-40-27-25(37)23(35)20(32)15(7-29)42-27/h3-6,15-16,20-21,23-30,32-33,35-38H,7-8H2,1-2H3/t15-,16-,20-,21-,23+,24+,25-,26-,27-,28-/m1/s1

InChIKey

InChIKey=YMXXCMGLMRYEQD-BFTLVBKUSA-N

SMILES

O(C1=C2C(C(=O)C=3C(C2=O)=C(O)C=C(C)C3)=CC(OC)=C1)[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O

Canonical SMILES

O=C1C=2C=C(OC)C=C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C2C(=O)C5=C(O)C=C(C=C15)C

Other Names for this Substance

  • 9,10-Anthracenedione, 1-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-8-hydroxy-3-methoxy-6-methyl-
  • 1-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-8-hydroxy-3-methoxy-6-methyl-9,10-anthracenedione
  • NSC 374115
  • Physcion-8-O-β-gentiobioside