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382607-78-5

382607-78-5 Structure

382607-78-5 Structure
IdentificationBack Directory
[Name]

(2R,3R,4S,5S,6R)-2-((8-(2-aMino-6-((4-broMothiophen-2-yl)Methoxy)-9H-purin-9-yl)octyl)oxy)-6-(hydroxyMethyl)tetrahydro-2H-pyran-3,4,5-triol
[CAS]

382607-78-5
[Synonyms]

O6BTG-C8-βGlu
O6BTG-octylglucoside
Glucose-conjugated MGMT inhibitor
β-D-Glucopyranoside, 8-[2-aMino-6-[(4-broMo-2-thienyl)Methoxy]-9H-purin-9-yl]octyl
8-[2-Amino-6-[(4-bromo-2-thienyl)methoxy]-9H-purin-9-yl]octyl beta-D-glucopyranoside
(2R,3R,4S,5S,6R)-2-[8-[2-amino-6-[(4-bromothiophen-2-yl)methoxy]purin-9-yl]octoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(2R,3R,4S,5S,6R)-2-((8-(2-aMino-6-((4-broMothiophen-2-yl)Methoxy)-9H-purin-9-yl)octyl)oxy)-6-(hydroxyMethyl)tetrahydro-2H-pyran-3,4,5-triol
[Molecular Formula]

C24H34BrN5O7S
[MDL Number]

MFCD22124457
[MOL File]

382607-78-5.mol
[Molecular Weight]

616.53
Chemical PropertiesBack Directory
[Boiling point ]

847.4±75.0 °C(Predicted)
[density ]

1.70
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 100 mg/mL (162.20 mM; Need ultrasonic)
[form ]

Powder
[pka]

12.95±0.70(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

O6BTG-octylglucoside is a potent O6-methylguanine-DNAmethyl-transferase (MGMT) inhibitor, with IC50s of 32 nM in vitro (cell extracts) and 10 nM in HeLa S3 cells.
[IC 50]

MGMT: 32 nM (IC50)
[References]

[1] Jost Reinhard, et al. Inactivation of O6-methylguanine-DNA methyltransferase by glucose-conjugated inhibitors. Int.J.Cancer. (2001) 93,373-379.
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