S)-α-Amino-3-[(2-carboxyphenyl)methyl]-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid

CAS Registry Number®

745055-91-8
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CAS Name

S)-α-Amino-3-[(2-carboxyphenyl)methyl]-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid

Molecular Formula

C15H15N3O6

Molecular Mass

333.30

Cite this Page

S)-α-Amino-3-[(2-carboxyphenyl)methyl]-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=745055-91-8 (retrieved 2024-03-29) (CAS RN: 745055-91-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    207.9-208.5 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=UUIYULWYHDSXHL-NSHDSACASA-N

SMILES

C(N1C(=O)N(C[C@@H](C(O)=O)N)C=CC1=O)C2=C(C(O)=O)C=CC=C2

Canonical SMILES

O=C(O)C=1C=CC=CC1CN2C(=O)C=CN(C2=O)CC(N)C(=O)O

Other Names for this Substance

  • 1(2H)-Pyrimidinepropanoic acid, α-amino-3-[(2-carboxyphenyl)methyl]-3,4-dihydro-2,4-dioxo-, (αS)-
  • S)-α-Amino-3-[(2-carboxyphenyl)methyl]-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid
  • UBP 302

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