![N-[2-HYDROXY-5-(9-PHENYL-XANTHEN-9-YLOXY)-CYCLOPENTYL-1-(THYMIN-1-YL)]-ACETAMIDE](/api/spectrum/Z6MRlQ1fhl/structure.png?h=300&w=458 "N-[2-HYDROXY-5-(9-PHENYL-XANTHEN-9-YLOXY)-CYCLOPENTYL-1-(THYMIN-1-YL)]-ACETAMIDE")
| SpectraBase Compound ID | Iwuh3BORkVy |
|---|---|
| InChI | InChI=1S/2C31H29N3O6/c2*1-19-17-34(30(38)33-29(19)37)18-27(36)32-28-23(35)15-16-26(28)40-31(20-9-3-2-4-10-20)21-11-5-7-13-24(21)39-25-14-8-6-12-22(25)31/h2*2-14,17,23,26,28,35H,15-16,18H2,1H3,(H,32,36)(H,33,37,38)/t2*23-,26-,28-/m11/s1 |
| InChIKey | ARLLISRCDZLMJG-KMCLQHSPSA-N |
| Mol Weight | 1079.18 g/mol |
| Molecular Formula | C62H58N6O12 |
| Exact Mass | 1078.411271 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Z6MRlQ1fhl |
|---|---|
| Name | N-[2-HYDROXY-5-(9-PHENYL-XANTHEN-9-YLOXY)-CYCLOPENTYL-1-(THYMIN-1-YL)]-ACETAMIDE |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H58N6O12 |
| InChI | InChI=1S/2C31H29N3O6/c2*1-19-17-34(30(38)33-29(19)37)18-27(36)32-28-23(35)15-16-26(28)40-31(20-9-3-2-4-10-20)21-11-5-7-13-24(21)39-25-14-8-6-12-22(25)31/h2*2-14,17,23,26,28,35H,15-16,18H2,1H3,(H,32,36)(H,33,37,38)/t2*23-,26-,28-/m11/s1 |
| InChIKey | ARLLISRCDZLMJG-KMCLQHSPSA-N |
| Literature Reference Author | D.R.AHN,M.MOSIMANN,C.J.LEUMANN |
| Literature Reference Citation | J.ORG.CHEM.,68,7693(2003) |
| Literature Reference DOI | 10.1021/jo034143q |
| Molecular Weight | 1079.176 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU27396 |