Analyte Name

4-((3-((2S)-2-amino-2-carboxyethyl)-2,6-dioxopyrimidin-1-yl)methyl)benzoic acid

CAS Number

544697-47-4

Molecular Formula

C15 H15 N3 O6

Molecular Weight

333.296

Accurate Mass

333.096

SMILES

N[C@@H](CN1C=CC(=O)N(Cc2ccc(cc2)C(=O)O)C1=O)C(=O)O

InChI

InChI=1S/C15H15N3O6/c16-11(14(22)23)8-17-6-5-12(19)18(15(17)24)7-9-1-3-10(4-2-9)13(20)21/h1-6,11H,7-8,16H2,(H,20,21)(H,22,23)/t11-/m0/s1

IUPAC

4-[[3-[(2S)-2-amino-2-carboxyethyl]-2,6-dioxopyrimidin-1-yl]methyl]benzoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat