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64005-90-9

64005-90-9 Structure

64005-90-9 Structure
IdentificationBack Directory
[Name]

DIETHYL-1,3,6,8-TETRAHYDRO-1,3,6,8-TETRAOXOBENZO[IMN][3,8]PHENANTHROLINE-2,7-DIACETATE
[CAS]

64005-90-9
[Synonyms]

PIB
PiB >=98% (HPLC)
WNKQGFNIIHNGQM-UHFFFAOYSA-N
PPIase-Parvulin Inhibitor - CAS 64005-90-9 - Calbiochem
DIETHYL-1,3,6,8-TETRAHYDRO-1,3,6,8-TETRAOXOBENZO[IMN][3,8]PHENANTHROLINE-2,7-DIACETATE
Benzo[lmn][3,8]phenanthroline-2,7-diacetic acid, 1,3,6,8-tetrahydro-1,3,6,8-tetraoxo-, 2,7-diethyl ester
[Molecular Formula]

C22H18N2O8
[MDL Number]

MFCD00333607
[MOL File]

64005-90-9.mol
[Molecular Weight]

438.39
Chemical PropertiesBack Directory
[storage temp. ]

2-8°C
[solubility ]

DMSO: soluble1-2mg/mL (warmed)
[form ]

Brownish solid
[color ]

white to light brown
[InChI]

InChI=1S/C18H18N2O8/c1-3-23-15(21)9-19-25-11-5-7-13-18-14(8-6-12(26-19)17(11)18)28-20(27-13)10-16(22)24-4-2/h5-8H,3-4,9-10H2,1-2H3
[InChIKey]

RUZSTTGSEVILES-UHFFFAOYSA-N
[SMILES]

C12=CC=C3C4C1=C(C=CC=4ON(CC(OCC)=O)O3)ON(CC(OCC)=O)O2
Safety DataBack Directory
[Symbol(GHS) ]


GHS09
[Signal word ]

Warning
[Hazard statements ]

H400
[Precautionary statements ]

P273-P391-P501
[Hazard Codes ]

N
[Risk Statements ]

50
[Safety Statements ]

61
[WGK Germany ]

3
Hazard InformationBack Directory
[Uses]

PPIase-Parvulin inhibitor (compound B) is a cell-permeable inhibitor targeting PPIase Pin1 and Par14, with IC50s of 1.5 and 1.0 μM, respectively. PPIase-Parvulin inhibitor has anticancer activity and inhibits the growth and proliferation of mouse embryonic fibroblasts (MEFs)[1].
[Biological Activity]

PiB is an inhibitor of the peptidylprolyl isomerase Pin-1. Inhibition of Pin-1 leads to destabilization of the transcription factor Nanogwhich is required for maintenance of embryonic stem cell cultures.
[References]

[1] Uchida T, et al. Pin1 and Par14 peptidyl prolyl isomerase inhibitors block cell proliferation. Chem Biol. 2003 Jan;10(1):15-24. DOI:10.1016/s1074-5521(02)00310-1
Spectrum DetailBack Directory
[Spectrum Detail]

DIETHYL-1,3,6,8-TETRAHYDRO-1,3,6,8-TETRAOXOBENZO[IMN][3,8]PHENANTHROLINE-2,7-DIACETATE(64005-90-9)1HNMR
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