![2-(3-OXO-3H-BENZO-[F]-CHROMEN-4-YL)-N-(THYMIDIN-5'-YL)-ACETAMIDE](/api/spectrum/5jhnFffkf6Y/structure.png?h=300&w=458 "2-(3-OXO-3H-BENZO-[F]-CHROMEN-4-YL)-N-(THYMIDIN-5'-YL)-ACETAMIDE")
| SpectraBase Compound ID | AGelhObs1Sd |
|---|---|
| InChI | InChI=1S/C25H23N3O7/c1-13-12-28(25(33)27-24(13)32)21-10-17(29)19(34-21)11-26-20(30)8-15-9-22(31)35-18-7-6-14-4-2-3-5-16(14)23(15)18/h2-7,9,12,17,19,21,29H,8,10-11H2,1H3,(H,26,30)(H,27,32,33)/t17-,19+,21+/m1/s1 |
| InChIKey | DSFDNTUPLQDVTH-LMNJBCLMSA-N |
| Mol Weight | 477.47 g/mol |
| Molecular Formula | C25H23N3O7 |
| Exact Mass | 477.1536 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5jhnFffkf6Y |
|---|---|
| Name | 2-(3-OXO-3H-BENZO-[F]-CHROMEN-4-YL)-N-(THYMIDIN-5'-YL)-ACETAMIDE |
| Compound Number | 12C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H23N3O7 |
| InChI | InChI=1S/C25H23N3O7/c1-13-12-28(25(33)27-24(13)32)21-10-17(29)19(34-21)11-26-20(30)8-15-9-22(31)35-18-7-6-14-4-2-3-5-16(14)23(15)18/h2-7,9,12,17,19,21,29H,8,10-11H2,1H3,(H,26,30)(H,27,32,33)/t17-,19+,21+/m1/s1 |
| InChIKey | DSFDNTUPLQDVTH-LMNJBCLMSA-N |
| Literature Reference Author | I.KOSIOVA,A.JANICOVA,P.KOIS |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,2,23,1(2006) |
| Literature Reference DOI | 10.1186/1860-5397-2-23 |
| Molecular Weight | 477.474 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWBT10953 |