β-D-Glucopyranosiduronic acid, 4-[1,3-dihydro-1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl, sodium salt (1:1)

CAS Registry Number®

6820-54-8

CAS Name

β-D-Glucopyranosiduronic acid, 4-[1,3-dihydro-1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl, sodium salt (1:1)

Molecular Formula

C26H22O10.Na

Cite this Page

β-D-Glucopyranosiduronic acid, 4-[1,3-dihydro-1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6820-54-8 (retrieved 2024-11-22) (CAS RN: 6820-54-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H22O10.Na/c27-15-9-5-13(6-10-15)26(18-4-2-1-3-17(18)24(33)36-26)14-7-11-16(12-8-14)34-25-21(30)19(28)20(29)22(35-25)23(31)32;/h1-12,19-22,25,27-30H,(H,31,32);/t19-,20-,21+,22-,25+,26?;/m0./s1

InChIKey

InChIKey=MDPZZYVDIVGGOM-PDFLYTMFSA-N

SMILES

O=C1OC(C=2C1=CC=CC2)(C3=CC=C(O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)C=C3)C5=CC=C(O)C=C5.[Na]

Canonical SMILES

[Na].O=C(O)C1OC(OC2=CC=C(C=C2)C3(OC(=O)C=4C=CC=CC43)C5=CC=C(O)C=C5)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, 4-[1,3-dihydro-1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl, sodium salt (1:1)
  • Glucopyranosiduronic acid, p-[3-(p-hydroxyphenyl)phthalidyl]phenyl, monosodium salt, β-D-
  • β-D-Glucopyranosiduronic acid, 4-[1,3-dihydro-1-(4-hydroxyphenyl)-3-oxo-1-isobenzofuranyl]phenyl, monosodium salt
  • Glucosiduronic acid, p-[3-(p-hydroxyphenyl)phthalidyl]phenyl, sodium salt
  • Phenolphthalein β-D-glucuronide sodium salt

Deleted or Replaced CAS Registry Numbers

906345-80-0

CAS INSIGHTSTM
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