Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pemetrexed [INN:BAN]
RN: 137281-23-3
UNII: 04Q9AIZ7NO
InChIKey: WBXPDJSOTKVWSJ-ZDUSSCGKSA-N

Note

  • A guanine-derived ANTINEOPLASTIC AGENT that functions as a NUCLEIC ACID SYNTHESIS INHIBITOR through its binding to, and inhibition of, THYMIDYLATE SYNTHASE.

Molecular Formula

  • C20-H21-N5-O6

Molecular Weight

  • 427.4149
 

Classification Codes

  • Antimetabolites
  • Antimetabolites, Antineoplastic
  • Antineoplastic Agents
  • Enzyme Inhibitors
  • Folic Acid Antagonists
  • Noxae
  • Nucleic Acid Synthesis Inhibitors

Names and Synonyms

Results Name

  • Pemetrexed [INN:BAN]

Name of Substance

  • Pemetrexed
  • Pemetrexed [INN:BAN]

MeSH Heading

  • Pemetrexed

Synonyms

  • Alimta
  • HSDB 7316
  • N-(4-(2-(2-Amino-3,4-dihydro-4-oxo-7H-pyrrolo(2,3-d)pyrimdin-5-yl)ethyl)benzoyl)glutamic acid
  • Pemetrexed
  • Premetrexed [Common mis-spelling]
  • UNII-04Q9AIZ7NO

Systematic Name

  • L-Glutamic acid, N-(4-(2-(2-amino-4,7-dihydro-4-oxo-1H-pyrrolo(2,3-d)pyrimidin-5-yl)ethyl)benzoyl)-

Registry Numbers

CAS Registry Number

  • 137281-23-3

FDA UNII

  • 04Q9AIZ7NO

System Generated Number

  • 0137281233

Structure Descriptors

InChI

1S/C20H21N5O6/c21-20-24-16-15(18(29)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(28)23-13(19(30)31)7-8-14(26)27/h1-2,4-5,9,13H,3,6-8H2,(H,23,28)(H,26,27)(H,30,31)(H4,21,22,24,25,29)/t13-/m0/s1

InChIKey

WBXPDJSOTKVWSJ-ZDUSSCGKSA-N

Smiles

NC1=Nc2[nH]cc(CCc3ccc(cc3)C(=O)N[C@@H](CCC(=O)O)C(=O)O)c2C(=O)N1