| SpectraBase Spectrum ID |
85MqqKrm66h |
| Name |
(Diethoxy-phosphoryl)-[(2R,3S,5R)-2-[(diethoxy-phosphoryl)-ethoxycarbonyl-methoxymethyl]-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-3-yloxy]-acetic acid ethyl ester |
| Alternate Name(s) |
3'-O-[diethyl(ethoxycarbonyl)phosphonomethyl]thymidine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H44N2O15P2 |
| InChI |
InChI=1S/C26H44N2O15P2/c1-8-35-22(30)24(44(33,38-10-3)39-11-4)37-16-19-18(14-20(42-19)28-15-17(7)21(29)27-26(28)32)43-25(23(31)36-9-2)45(34,40-12-5)41-13-6/h15,18-20,24-25H,8-14,16H2,1-7H3,(H,27,29,32)/t18-,19+,20+,24?,25?/m0/s1 |
| InChIKey |
BSSDBBHSSXPELL-GCJGPMEHSA-N |
| Molecular Weight |
686.585 g/mol |
| SMILES |
N1C(C(=CN(C1=O)[C@@]1(O[C@](COC(P(=O)(OCC)OCC)C(=O)OCC)([C@@](OC(P(=O)(OCC)OCC)C(=O)OCC)(C1)[H])[H])[H])C)=O |
| SPLASH |
splash10-0006-9503000000-cd4bf49e03f2a25945b9 |
| Source of Spectrum |
F-68-1906-37c |
| Wiley ID |
1707953 |
![(Diethoxy-phosphoryl)-[(2R,3S,5R)-2-[(diethoxy-phosphoryl)-ethoxycarbonyl-methoxymethyl]-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-3-yloxy]-acetic acid ethyl ester](/api/spectrum/85MqqKrm66h/structure.png?h=300&w=458 "(Diethoxy-phosphoryl)-[(2R,3S,5R)-2-[(diethoxy-phosphoryl)-ethoxycarbonyl-methoxymethyl]-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-3-yloxy]-acetic acid ethyl ester")
