| SpectraBase Spectrum ID |
EVbQ4X3Ysk |
| Name |
1-(Psoralen-8-yloxy)-8-(adenin-9-yl)-3,6-dioxaoctane |
| Alternate Name(s) |
9-(2-{2-[2-(6-amino-9H-purin-9-yl)ethoxy]ethoxy}ethoxy)-7H-furo[3,2-g]chromen-7-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21N5O6 |
| InChI |
InChI=1S/C22H21N5O6/c23-21-17-22(25-12-24-21)27(13-26-17)4-6-29-7-8-30-9-10-32-20-18-15(3-5-31-18)11-14-1-2-16(28)33-19(14)20/h1-3,5,11-13H,4,6-10H2,(H2,23,24,25) |
| InChIKey |
JFFAYBCENSNXEF-UHFFFAOYSA-N |
| Molecular Weight |
451.439 g/mol |
| SMILES |
Nc1c2nc[n](c2ncn1)CCOCCOCCOc1c2OC(=O)C=Cc2cc2c1occ2 |
| SPLASH |
splash10-1170-0980000000-99a49482cb4fe6f672ec |
| Source of Spectrum |
KC-1983-1812-0 |
| Wiley ID |
1387939 |
