| SpectraBase Spectrum ID |
9cVypUfLmCx |
| Name |
Dimethyl N-{4-[2-(2-pivaloylamino-4(3H)-oxo-7H-pyrrolo[2,3-d]pyrimidine-6yl)ethyl]benzoyl}-L-glutamate |
| Alternate Name(s) |
Dimethyl (2S)-2-{[4-(2-{2-[(2,2-dimethylpropanoyl)amino]-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-6-yl}ethyl)benzoyl]amino}pentanedioate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H33N5O7 |
| InChI |
InChI=1S/C27H33N5O7/c1-27(2,3)25(37)32-26-30-21-18(23(35)31-26)14-17(28-21)11-8-15-6-9-16(10-7-15)22(34)29-19(24(36)39-5)12-13-20(33)38-4/h6-7,9-10,14,19H,8,11-13H2,1-5H3,(H,29,34)(H3,28,30,31,32,35,37)/t19-/m0/s1 |
| InChIKey |
KXXSGYSCEWQHAS-IBGZPJMESA-N |
| Molecular Weight |
539.589 g/mol |
| SMILES |
N1C(c2c(N=C1NC(C(C)(C)C)=O)[nH]c(c2)CCc1ccc(C(N[C@](C(=O)OC)(CCC(=O)OC)[H])=O)cc1)=O |
| SPLASH |
splash10-0002-1190000000-92143d6690cf658bd74d |
| Source of Spectrum |
H1-36-1903-15 |
| Wiley ID |
755450 |
![Dimethyl N-{4-[2-(2-pivaloylamino-4(3H)-oxo-7H-pyrrolo[2,3-d]pyrimidine-6yl)ethyl]benzoyl}-L-glutamate](/api/spectrum/9cVypUfLmCx/structure.png?h=300&w=458 "Dimethyl N-{4-[2-(2-pivaloylamino-4(3H)-oxo-7H-pyrrolo[2,3-d]pyrimidine-6yl)ethyl]benzoyl}-L-glutamate")
