#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
Compound with spectra: 1 NMR
![#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](/api/compound/GMVOoolgEjq.png?ph=true&h=300&w=458 "#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")
| SpectraBase Compound ID | GMVOoolgEjq |
|---|---|
| InChI | InChI=1S/C23H26N6O6.2Na/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);;/q;2*+1/p-2/b25-12-;;/t16-;;/m0../s1 |
| InChIKey | UHMFLUFQXDWKIK-NPEBSPIUSA-L |
| Mol Weight | 526.46053856 g/mol |
| Molecular Formula | C23H24N6Na2O6 |
| Exact Mass | 526.155271 g/mol |
| Parent InChIKey | WTQOMFBCQAJBJV-BNHLPYHESA-L |
| Enantiomer InChIKey | UHMFLUFQXDWKIK-TWNCYLEUSA-L |
| Racemate InChIKey | UHMFLUFQXDWKIK-VPLOVZOKSA-L |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | D2O |
(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
#(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 |