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Chemical structure of Tegatrabetan

GC39159

Tegatrabetan

Also known as N-[3,6-bis[[(3R,5S)-3,5-dimethylpiperidin-1-yl]sulfonyl]-10-nitrosoanthracen-9-yl]hydroxylamine

Tegatrabetan (BC2059) is a β-Catenin antagonist· Tegatrabetan disrupts the binding of β-catenin with the scaffold protein transducin β-like 1 (TBL1)

ChemicalCAS1227637-23-1MW588.74FormulaC28H36N4O6S2
CAS number
1227637-23-1
Molecular weight
588.74
Formula
C28H36N4O6S2
Solubility
DMSO： 125 mg/mL (212·32 mM)
InChIKey
OMWCXCBGEFHCTN-FGYAAKKASA-N
Catalogue number
GC39159
Brand
GLPBIO
Computed properties PubChem CID 46212391 · XLogP 5 · TPSA 153 Ų · H-bond donors 2
XLogP
5
TPSA
153 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
40

SMILES C[C@@H]1C[C@@H](CN(C1)S(=O)(=O)C2=CC3=C(C=C2)C(=C4C=CC(=CC4=C3N=O)S(=O)(=O)N5C[C@@H](C[C@@H](C5)C)C)NO)C

Computed descriptors from PubChem (CID 46212391), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
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