BGC > Product Search > N-(4-(Methylamino)benzoyl)-L-glutamic acid | 52980-68-4

Molecular Formula: C13H16N2O5
Molecular Weight: 280.278

Description :
An impurity of Methotrexate, an antimetabolite and immunosuppressant used in chemotherapy and auto-immune diseases. This impurity also acts as an inhibitor of human DNA methyltransferase.

• Molecular Weight :280.28
• Purity :> 95%

Molecular Formula :
C13H16N2O5
Canonical SMILES :
CNC1=CC=C(C=C1)C(=O)NC(CCC(=O)O)C(=O)O
InChI :
InChI=1S/C13H16N2O5/c1-14-9-4-2-8(3-5-9)12(18)15-10(13(19)20)6-7-11(16)17/h2-5,10,14H,6-7H2,1H3,(H,15,18)(H,16,17)(H,19,20)/t10-/m0/s1
InChIKey :
UFBUCKLNZUNJHS-JTQLQIEISA-N
Synonyms :
N-(4-(Methylamino)benzoyl)-L-glutamic acid; N-(p-(Methylamino)benzoyl)glutamic acid; (p-Methylaminobenzoyl)-L-glutamic Acid; N-[p-(Methylamino)benzoyl]-L-glutamic acid; NSC 138419

More details are to be found here

Description :
An impurity of Methotrexate, an antimetabolite and immunosuppressant used in chemotherapy and auto-immune diseases. This impurity also acts as an inhibitor of human DNA methyltransferase.

• Molecular Weight :280.28
• Purity :> 95%

Molecular Formula :
C13H16N2O5
Canonical SMILES :
CNC1=CC=C(C=C1)C(=O)NC(CCC(=O)O)C(=O)O
InChI :
InChI=1S/C13H16N2O5/c1-14-9-4-2-8(3-5-9)12(18)15-10(13(19)20)6-7-11(16)17/h2-5,10,14H,6-7H2,1H3,(H,15,18)(H,16,17)(H,19,20)/t10-/m0/s1
InChIKey :
UFBUCKLNZUNJHS-JTQLQIEISA-N
Synonyms :
N-(4-(Methylamino)benzoyl)-L-glutamic acid; N-(p-(Methylamino)benzoyl)glutamic acid; (p-Methylaminobenzoyl)-L-glutamic Acid; N-[p-(Methylamino)benzoyl]-L-glutamic acid; NSC 138419

More details are to be found here