3-Indolyl-β-D-glucuronide
CAS Registry Number®
35804-66-1
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CAS Name
3-Indolyl-β-D-glucuronideMolecular Formula
C14H15NO7Molecular Mass
309.27Cite this Page
3-Indolyl-β-D-glucuronide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=35804-66-1 (retrieved ) (CAS RN: 35804-66-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C14H15NO7/c16-9-10(17)12(13(19)20)22-14(11(9)18)21-8-5-15-7-4-2-1-3-6(7)8/h1-5,9-12,14-18H,(H,19,20)/t9-,10-,11+,12-,14+/m0/s1
InChIKey
InChIKey=KUYNOZVWCFXSNE-BYNIDDHOSA-N
SMILES
O(C=1C=2C(NC1)=CC=CC2)[C@@H]3O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]3O
Canonical SMILES
O=C(O)C1OC(OC2=CNC=3C=CC=CC23)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranosiduronic acid, 1H-indol-3-yl
- 1H-Indol-3-yl β-D-glucopyranosiduronic acid
- Indolyl 3-glucuronide
- Indoxyl β-D-glucuronide
- Indol-3-yl β-D-glucosiduronic acid
Deleted or Replaced CAS Registry Numbers
95983-48-5, 149231-45-8, 209347-91-1
