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Pidotimod Impurity 23 (L-Pyroglutamic Acid Dimer)

CAT: 1299-RM-P136049-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-P136049-01Size:10 mg
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CAS Number
112600-92-7
Synonyms
(S) -5-oxo-1- ((S) -5-oxopyrrolidine-2-carbonyl) pyrrolidine-2-carboxylic acid
Molecular Formula
C10H12N2O5
Molecular Weight
240.22
Target Alternative Name
Pidotimod
Product Name Synonym
(S) -5-oxo-1- ((S) -5-oxopyrrolidine-2-carbonyl) pyrrolidine-2-carboxylic acid

Chemical Information

1-L-Pyroglutamyl-L-pyroglutamic Acid
CAS Number112600-92-7
PubChem CID131844569
IUPAC Name(2S)-5-oxo-1-[(2S)-5-oxopyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC10H12N2O5
Molecular Weight240.21
XLogP-1.4
Topological Polar Surface Area104
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity406
SMILES
C1CC(=O)N[C@@H]1C(=O)N2[C@@H](CCC2=O)C(=O)O
InChI
InChI=1S/C10H12N2O5/c13-7-3-1-5(11-7)9(15)12-6(10(16)17)2-4-8(12)14/h5-6H,1-4H2,(H,11,13)(H,16,17)/t5-,6-/m0/s1
InChIKey
LGVSGLWADQKMKV-WDSKDSINSA-N
Chemical Structure
2D Structure
2D structure of 1-L-Pyroglutamyl-L-pyroglutamic Acid
CAS: 112600-92-7
CID: 131844569
Formula: C10H12N2O5
MW: 240.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight240.21
XLogP3-1.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass240.07462149
Monoisotopic Mass240.07462149
Topological Polar Surface Area104 Ų
Heavy Atom Count17
Formal Charge0
Complexity406
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes