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Chemical structure of LC3-mHTT-IN-AN1

GC39395

LC3-mHTT-IN-AN1

Also known as (3Z)-5-bromo-3-[(3-bromo-4,5-dihydroxyphenyl)methylidene]-1H-indol-2-one

LC3-mHTT-IN-AN1 (Compound AN1) is a mHTT-LC3 linker compound, which interacts with both mutant huntingtin protein (mHTT) and LC3B but not with wtHTT or irrelevant control proteins

ChemicalCAS486443-73-6MW411.04FormulaC15H9Br2NO3
CAS number
486443-73-6
Molecular weight
411.04
Formula
C15H9Br2NO3
Solubility
DMSO： 125 mg/mL (304·11 mM); Water： ＜ 0·1 mg/mL (insoluble)
InChIKey
GPKLWRHHVIBYEO-KMKOMSMNSA-N
Catalogue number
GC39395
Brand
GLPBIO
Computed properties PubChem CID 1759437 · XLogP 3.6 · TPSA 69.6 Ų · H-bond donors 3
XLogP
3.6
TPSA
69.6 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
21

SMILES C1=CC2=C(C=C1Br)/C(=C/C3=CC(=C(C(=C3)Br)O)O)/C(=O)N2

Computed descriptors from PubChem (CID 1759437), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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