Product Information
Name:Pemetrexed-d5 Diethyl Ester
Controlled Product
Synonyms:
- Diethyl 2-(4-(2-(2-Amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl)benzamido)pentanedioate-d5
Brand:TRC
Description:Applications Isotope labelled Pemetrexed-d5 Diethyl Ester is an protected intermediate in the synthesis of Pemetrexed (P219500), an multitargeted antifolate that inhibits thymidylate synthase as well as other folate dependent enzymes.References Kjell, D.P., et al.: Org. Proc. Res. Development., 9, 738 (2005); Taylor, E. C., et al.: J. Org. Chem., 66, 3726 (2001);
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Chemical properties
Molecular weight:488.548
Formula:C24D5H24N5O6
Color/Form:Neat
InChI:InChI=1S/C24H29N5O6/c1-3-34-18(30)12-11-17(23(33)35-4-2)27-21(31)15-8-5-14(6-9-15)7-10-16-13-26-20-19(16)22(32)29-24(25)28-20/h5-6,8-9,13,17H,3-4,7,10-12H2,1-2H3,(H,27,31)(H4,25,26,28,29,32)/t17-/m0/s1/i11D2,12D2,17D
InChI key:InChIKey=DEJAOZLLEHXUBF-REEALJHGSA-N
SMILES:[2H]C([2H])(C(=O)OCC)C([2H])([2H])[C@]([2H])(NC(=O)c1ccc(CCc2c[nH]c3[nH]c(N)nc(=O)c23)cc1)C(=O)OCC
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