β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate]

CAS Registry Number®

72967-59-0

CAS Name

β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate]

Molecular Formula

C18H19ClN2O11S

Molecular Mass

506.87

Cite this Page

β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=109521-63-3 (retrieved 2024-11-24) (CAS RN: 72967-59-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H19ClN2O11S/c19-9-5-10(21-6-7-2-1-3-30-7)8(4-11(9)33(20,28)29)17(27)32-18-14(24)12(22)13(23)15(31-18)16(25)26/h1-5,12-15,18,21-24H,6H2,(H,25,26)(H2,20,28,29)/t12-,13-,14+,15-,18-/m0/s1

InChIKey

InChIKey=RNVHHPUYELVHRE-GLRLOKQVSA-N

SMILES

N(CC1=CC=CO1)C2=C(C(O[C@@H]3O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)=O)C=C(S(N)(=O)=O)C(Cl)=C2

Canonical SMILES

O=C(O)C1OC(OC(=O)C2=CC(=C(Cl)C=C2NCC=3OC=CC3)S(=O)(=O)N)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranuronic acid, 1-[5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoate]
  • Furosemide glucuronide

Deleted or Replaced CAS Registry Numbers

109521-63-3

CAS INSIGHTSTM
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