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Chemical structure of 4-(Quinoxalin-2-yl)butane-1,2,3-triol

GC62763

4-(Quinoxalin-2-yl)butane-1,2,3-triol

Also listed as 2-(2',3',4'-Trihydroxybutyl)quinoxaline

2-(2',3',4'-Trihydroxybutyl)quinoxaline is a food metabolite

ChemicalCAS42015-38-3MW234.25FormulaC12H14N2O3
CAS number
42015-38-3
Molecular weight
234.25
Formula
C12H14N2O3
InChIKey
KFKHJQAEESRVHL-UHFFFAOYSA-N
Catalogue number
GC62763
Brand
GLPBIO
Computed properties PubChem CID 14298609 · XLogP -0.4 · TPSA 86.5 Ų · H-bond donors 3
XLogP
-0.4
TPSA
86.5 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
17

SMILES C1=CC=C2C(=C1)N=CC(=N2)CC(C(CO)O)O

Computed descriptors from PubChem (CID 14298609), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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