5-Hydroxy Tryptophol beta-D-Glucuronide Sodium Salt

Analyte Name

5-Hydroxy Tryptophol b-D-Glucuronide Sodium Salt

Molecular Formula

C16H19NNaO8

Molecular Weight

375.31

Accurate Mass

375.09

SMILES

OCCC1=CNC2=CC=C(O[C@@H]3O[C@H](C(O[Na])=O)[C@@H](O)[C@H](O)[C@H]3O)C=C21

InChI

InChI=1S/C16H19NO8.Na/c18-4-3-7-6-17-10-2-1-8(5-9(7)10)24-16-13(21)11(19)12(20)14(25-16)15(22)23;/h1-2,5-6,11-14,16-21H,3-4H2,(H,22,23);/q;+1/p-1/t11-,12-,13+,14-,16+;/m0./s1

IUPAC

sodium (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((3-(2-hydroxyethyl)-1H-indol-5-yl)oxy)tetrahydro-2H-pyran-2-carboxylate

Alternate CAS Number

Free acid: 27939-38-4

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

Purity

>95% (HPLC)