| IUPAC name | disodium;(2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioate;heptahydrate |
| canonical smiles | C1=CC(=CC=C1CCC2=CNC3=C2C(=O)NC(=N3)N)C(=O)NC(CCC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.O.[Na+].[Na+] |
| inchi | InChI=1S/C20H21N5O6.2Na.7H2O/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);;;7*1H2/q;2*+1;;;;;;;/p-2/t13-;;;;;;;;;/m0........./s1 |
| inchi key | QJVSMHJWAOSBMD-MYXYZBIASA-L |
| molecular formula | C20H33N5Na2O13 |
| synonyms | Pemetrexed disodium heptahydrate357166-29-1AlimtaUNII-9T47E4OM16Pemetrexed sodium hydrate |
| Compound Description | Pemetrexed disodium heptahydrate is an organic sodium salt that is the heptahydrate form of pemetrexed disodium. Inhibits thymidylate synthase , 421 dihydrofolate reductase , and glycinamide ribonucleotide formyltransferase . It has a role as an antimetabolite, an antineoplastic agent, an EC 1.5.1.3 inhibitor, an EC 2.1.1.45 inhibitor and an EC 2.1.2.2 inhibitor. It is an organic sodium salt and a hydrate. It contains a pemetrexed disodium.A guanine-derived ANTINEOPLASTIC AGENT that functions as a NUCLEIC ACID SYNTHESIS INHIBITOR through its binding to, and inhibition of, THYMIDYLATE SYNTHASE.See also: Pemetrexed . |
