Pemetrexed

cas: 357166-29-1 — see every product listed under this CAS number, including other names

Pemetrexed (CAS 357166-29-1) is a chemical reagent available from Chemat. Available pack sizes: 500MG. Offered by: Supelco.

brandSupelco
catalog numberPHR1596-500MG
cas357166-29-1
size500MG
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Available pack sizes

brand size price
Supelco 500MG 969.60 Pln
Structural formula: {0} (CAS {1})

Pemetrexed disodium heptahydrate is an organic sodium salt that is the heptahydrate form of pemetrexed disodium. Inhibits thymidylate synthase (TS), 421 dihydrofolate reductase (DHFR), and glycinamide ribonucleotide formyltransferase (GARFT). It has a role as an antimetabolite, an antineoplastic agent, an EC 1.5.1.3 (dihydrofolate reductase) inhibitor, an EC 2.1.1.45 (thymidylate synthase) inhibitor and an EC 2.1.2.2 (phosphoribosylglycinamide formyltransferase) inhibitor. It is a hydrate and an organic sodium salt. It contains a pemetrexed disodium.

Source: ChEBI

Identity
Molecular formulaC20H33N5Na2O13
Molecular weight597.5 g/mol
IUPAC namedisodium;(2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioate;heptahydrate
InChIKeyQJVSMHJWAOSBMD-MYXYZBIASA-L
SMILESC1=CC(=CC=C1CCC2=CNC3=C2C(=O)NC(=N3)N)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.O.[Na+].[Na+]

Computed by PubChem (NCBI)

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