(2S)-2-[[4-[2-(2-(DIMETHYLAMINO)-METHYLENEAMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-PENTANEDIOIC-ACID
Compound with spectra: 1 NMR
![(2S)-2-[[4-[2-(2-(DIMETHYLAMINO)-METHYLENEAMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-PENTANEDIOIC-ACID](/api/compound/7fnbzGDtyZt.png?ph=true&h=300&w=458 "(2S)-2-[[4-[2-(2-(DIMETHYLAMINO)-METHYLENEAMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-PENTANEDIOIC-ACID")
| SpectraBase Compound ID | 7fnbzGDtyZt |
|---|---|
| InChI | InChI=1S/C23H26N6O6/c1-29(2)12-25-23-27-19-18(21(33)28-23)15(11-24-19)8-5-13-3-6-14(7-4-13)20(32)26-16(22(34)35)9-10-17(30)31/h3-4,6-7,11-12,16H,5,8-10H2,1-2H3,(H,26,32)(H,30,31)(H,34,35)(H2,24,27,28,33)/b25-12-/t16-/m0/s1 |
| InChIKey | WTQOMFBCQAJBJV-BNHLPYHESA-N |
| Mol Weight | 482.5 g/mol |
| Molecular Formula | C23H26N6O6 |
| Exact Mass | 482.191383 g/mol |
| Enantiomer InChIKey | WTQOMFBCQAJBJV-YQWDGLBASA-N |
| Racemate InChIKey | WTQOMFBCQAJBJV-ROTLSHHCSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
#7A;(2S)-2-[[4-[2-(2-(DIMETHYLAMINO)-METHYLENEAMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-PENTANEDIOIC-ACID-DISODIU
#(S,S)-9;(2S)-2-[[(2S)-2-[[4-[2-(2-AMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-4-CARBOXYBUTANOYL]-AMINO]-PENTANEDIOIC
#9;(2S)-2-[[(2S)-2-[[4-[2-(2-AMINO-4-OXO-4,7-DIHYDRO-1H-PYRROLO-[2,3-D]-PYRIMIDIN-5-YL)-ETHYL]-BENZOYL]-AMINO]-4-CARBOXYBUTANOYL]-AMINO]-PENTANEDIOIC-ACID
Dimethyl N-{4-[2-(2-pivaloylamino-4(3H)-oxo-7H-pyrrolo[2,3-d]pyrimidine-6yl)ethyl]benzoyl}-L-glutamate
Dimethyl N-{4-[2-(2-pivaloylamino-4(3H)-oxo-7H-pyrrolo[2,3-d]pyrimidine-6yl]ethynyl}-L-glutamate
Diethyl N-N-((2-(pivaloylamino)-3,4-dihydro-4-oxopyrido[2,3-d]pyrimidin-6-yl)methyl)-4-(aminomethyl)benzoyl]glutamate
2-AMINO-4,5,6,7,8,9-HEXAHYDROPYRIMIDO-[4.5-B]-INDOL-4-(3-H)-ONE
2-Methyl-3,5,6,7,8,9-hexahydro-4H-pyrimido(4,5-B)indol-4-one
9-(2-HYDROXYETHYL)-7-DEAZAGUANINE-7-CARBOXAMIDE
DIMETHYL-N-[4-[2-(2-AMINO-4,7-DIOXO-3,4,5,6,7,8-HEXAHYDROPYRIDO-[2,3-D]-PYRIMIDIN-6-YL)-ETHYL]-BENZOYL]-L-GLUTAMATE
| Title | Journal or Book | Year |
|---|---|---|
| Synthesis and Physicochemical Characterization of the Impurities of Pemetrexed Disodium, an Anticancer Drug | Molecules | 2015 |