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Pal-Glu (OSu) -OH

CAT: 0013-GTR19222172-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19222172-01Size:100 mg
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Description
Pal-Glu (OSu) -OH is a key building block for synthesizing Liraglutide, a GLP-1 receptor agonist used in diabetes research. This derivative facilitates studies on GLP-1 receptor activation and is employed in both in vitro binding assays and in vivo metabolic studies.
CAS Number
294855-91-7
Field of Research
Pharmacology & Drug Discovery
Smiles
CCCCCCCCCCCCCCCC (=O) N[C@@H] (CCC (=O) ON1C (=O) CCC1=O) C (O) =O
Molecular Formula
C25H42N2O7
Molecular Weight
482.618
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pal-Glu(OSu)-OH
CAS Number294855-91-7
PubChem CID87534712
IUPAC Name(2S)-5-(2,5-dioxopyrrolidin-1-yl)oxy-2-(hexadecanoylamino)-5-oxopentanoic acid
Molecular FormulaC25H42N2O7
Molecular Weight482.6
XLogP5.8
Topological Polar Surface Area130
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count21
Heavy Atom Count34
Formal Charge0
Complexity650
SMILES
CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)ON1C(=O)CCC1=O)C(=O)O
InChI
InChI=1S/C25H42N2O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(28)26-20(25(32)33)16-19-24(31)34-27-22(29)17-18-23(27)30/h20H,2-19H2,1H3,(H,26,28)(H,32,33)/t20-/m0/s1
InChIKey
KLBZDGJNRTVIAJ-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of Pal-Glu(OSu)-OH
CAS: 294855-91-7
CID: 87534712
Formula: C25H42N2O7
MW: 482.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight482.6
XLogP35.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count21
Exact Mass482.29920168
Monoisotopic Mass482.29920168
Topological Polar Surface Area130 Ų
Heavy Atom Count34
Formal Charge0
Complexity650
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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