Benzoyl glucuronide

CAS Registry Number®

19237-53-7

CAS Name

Benzoyl glucuronide

Molecular Formula

C13H14O8

Molecular Mass

298.25

Cite this Page

Benzoyl glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=19237-53-7 (retrieved 2024-11-21) (CAS RN: 19237-53-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14O8/c14-7-8(15)10(11(17)18)20-13(9(7)16)21-12(19)6-4-2-1-3-5-6/h1-5,7-10,13-16H,(H,17,18)/t7-,8-,9+,10-,13-/m0/s1

InChIKey

InChIKey=NLOPFVNXNMEEDI-UNLLLRGISA-N

SMILES

O(C(=O)C1=CC=CC=C1)[C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(O)C1OC(OC(=O)C=2C=CC=CC2)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranuronic acid, 1-benzoate
  • Glucopyranuronic acid, 1-benzoate, β-D-
  • Glucopyranuronic acid, 1-benzoate
  • Benzoyl glucuronide
  • Benzoic acid β-D-glucuronide

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Deleted or Replaced CAS Registry Numbers

96180-82-4, 19132-90-2, 26082-90-6, 29964-74-7, 30138-84-2, 30259-70-2

CAS INSIGHTSTM
Targeted protein degrader structure, illustration