CAS 1145-32-0 | Glycine, N-benzoylglycyl- | CAS Number 1145-32-0

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1145-32-0 | Glycine, N-benzoylglycyl-

CAS No: 1145-32-0 Catalog No: AG000EL3 MDL No:MFCD00046538

Product Description

Catalog Number:

AG000EL3

Chemical Name:

Glycine, N-benzoylglycyl-

CAS Number:

1145-32-0

Molecular Formula:

C11H12N2O4

Molecular Weight:

236.2240

MDL Number:

MFCD00046538

IUPAC Name:

2-[(2-benzamidoacetyl)amino]acetic acid

InChI:

InChI=1S/C11H12N2O4/c14-9(12-7-10(15)16)6-13-11(17)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,14)(H,13,17)(H,15,16)

InChI Key:

FWYPSSZPXQVFRB-UHFFFAOYSA-N

SMILES:

O=C(CNC(=O)c1ccccc1)NCC(=O)O

NSC Number:

89164

Properties

Complexity:

298

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.227g/mol

Monoisotopic Mass:

236.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.3

Literature

Title	Journal
Transport and signaling via the amino acid binding site of the yeast Gap1 amino acid transceptor.	Nature chemical biology 20090101
Substituted hippurates and hippurate analogs as substrates and inhibitors of peptidylglycine alpha-hydroxylating monooxygenase (PHM).	Bioorganic & medicinal chemistry 20081201
Fragmentation of deprotonated N-benzoylpeptides: formation of deprotonated oxazolones.	Journal of the American Society for Mass Spectrometry 20040401