2-Anthracenecarboxylic acid, 7-β-D-glucopyranosyl-9,10-dihydro-3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-, aluminum salt (3:1)

CAS Registry Number®

7061-55-4

CAS Name

2-Anthracenecarboxylic acid, 7-β-D-glucopyranosyl-9,10-dihydro-3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-, aluminum salt (3:1)

Molecular Formula

C22H20O13.1/3Al

Cite this Page

2-Anthracenecarboxylic acid, 7-β-D-glucopyranosyl-9,10-dihydro-3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-, aluminum salt (3:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7061-55-4 (retrieved 2024-11-23) (CAS RN: 7061-55-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H20O13.Al/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21;/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34);/t7-,14-,19+,20-,21+;/m1./s1

InChIKey

InChIKey=CHAPGLNLWYITBV-FJASXRKZSA-N

SMILES

O=C1C=2C(C(=O)C=3C1=C(C)C(C(O)=O)=C(O)C3)=C(O)C(O)=C(C2O)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O.[Al]

Canonical SMILES

[Al].O=C(O)C1=C(O)C=C2C(=O)C3=C(O)C(O)=C(C(O)=C3C(=O)C2=C1C)C4OC(CO)C(O)C(O)C4O

Other Names for this Substance

  • 2-Anthracenecarboxylic acid, 7-β-D-glucopyranosyl-9,10-dihydro-3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-, aluminum salt (3:1)

CAS INSIGHTSTM
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