N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID 1,5-DIETHYL ESTER 4-METHYLBENZENESULFONATE

CAS No.
165049-28-5
CCD No.
CCD01959409
Formula
C24 H29 N5 O6 . C7 H8 O3 S
MolWeight
655.725

Basic Information

Product Name: N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID 1,5-DIETHYL ESTER 4-METHYLBENZENESULFONATE
CAS: 165049-28-5
English Synonyms: N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID DIETHYL ESTER 4-METHYLBENZENESULFONATE (1:1) ; PEMETREXED DISODIUM INTERMEDIATE ; PEMETREXED DIETHYL ESTER (L-GLUTAMIC ACID, N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3HPYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-, 1,5-DIETHYL ESTER ) ; N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID 1,5-DIETHYL ESTER 4-METHYLBENZENESULFONATE ; (S)-DIETHYL 2-(4-(2-(2-AMINO-4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL)BENZAMIDO)PENTANEDIOATE 4-METHYLBENZENESULFONATE ; PEMETREXED DISODIUM INT-5 ; N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]L-GLUTAMIC ACID, 1, 5-DIETHYLESTER,4-METHYLBENZENESULFONATE (1:1) ; N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]L-GLUTAMIC ACID,1,5-DIETHYL ESTER,4-METHYLBENZENESULFONATE(1:1)
MDL Number.: MFCD12911689
H bond acceptor: 11
H bond donor: 4
Smile: CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)c1ccc(cc1)CCc2c[nH]c3c2c(=O)[nH]c(n3)N.Cc1ccc(cc1)S(=O)(=O)O
InChi: InChI=1S/C24H29N5O6.C7H8O3S/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;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,8-9,13,17H,3-4,7,10-12H2,1-2H3,(H,27,31)(H4,25,26,28,29,32);2-5H,1H3,(H,8,9,10)/t17-;/m0./s1
InChiKey: InChIKey=UANBXQTVHOIGGQ-LMOVPXPDSA-N

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