CAS 1160-54-9 | L-Proline, N-[(phenylmethoxy)carbonyl]glycyl- | CAS Number 1160-54-9

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1160-54-9 | L-Proline, N-[(phenylmethoxy)carbonyl]glycyl-

CAS No: 1160-54-9 Catalog No: AG000BDC MDL No:MFCD00037341

Product Description

Catalog Number:

AG000BDC

Chemical Name:

L-Proline, N-[(phenylmethoxy)carbonyl]glycyl-

CAS Number:

1160-54-9

Molecular Formula:

C15H18N2O5

Molecular Weight:

306.3138

MDL Number:

MFCD00037341

IUPAC Name:

(2S)-1-[2-(phenylmethoxycarbonylamino)acetyl]pyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C15H18N2O5/c18-13(17-8-4-7-12(17)14(19)20)9-16-15(21)22-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,21)(H,19,20)/t12-/m0/s1

InChI Key:

ZTUKZKYDJMGJDC-LBPRGKRZSA-N

SMILES:

O=C(OCc1ccccc1)NCC(=O)N1CCC[C@H]1C(=O)O

EC Number:

214-598-8

Properties

Complexity:

420

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

306.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

306.318g/mol

Monoisotopic Mass:

306.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7

Literature

Title	Journal
Synthesis and neuroprotective activity of analogues of glycyl-L-prolyl-L-glutamic acid (GPE) modified at the alpha-carboxylic acid.	Bioorganic & medicinal chemistry 20050117
Synthesis and pharmacological evaluation of side chain modified glutamic acid analogues of the neuroprotective agent glycyl-L-prolyl-L-glutamic acid (GPE).	Bioorganic & medicinal chemistry 20050117
Chiral separation of amines with N-benzoxycarbonylglycyl-L-proline as selector in non-aqueous capillary electrophoresis using methanol and 1,2-dichloroethane in the background electrolyte.	Journal of chromatography. A 20030117
Structures of prolyl oligopeptidase substrate/inhibitor complexes. Use of inhibitor binding for titration of the catalytic histidine residue.	The Journal of biological chemistry 20010112