| Name： | L-GLUTAMIC ACID, N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-, SODIUM SALT (1:2) |
| CAS： | 150399-23-8 |
| Synonyms： | PEMETREXED DISODIUM ; SODIUM (S)-2-(4-(2-(2-AMINO-4-OXO-4,7-DIHYDRO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL)BENZAMIDO)PENTANEDIOATE ; L-GLUTAMIC ACID, N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-, SODIUM SALT (1:2) ; PEMETREXED DISODIUM, 99% |
| MDL.： | MFCD07782095 |
| H bond acceptor： | 11 |
| H bond donor： | 4 |
| Smile： | c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| InChi： | InChI=1S/C20H21N5O6.2Na/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);;/q;2*+1/p-2/t13-;;/m0../s1 |
| InChiKey： | InChIKey=NYDXNILOWQXUOF-GXKRWWSZSA-L |
L-GLUTAMIC ACID, N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-,
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