| SpectraBase Spectrum ID |
Eh25f4NSc2e |
| Name |
25,26,27,28-Tetraacetoxy-5-(ethoxycarbonyl)-11,23-dimethyl-17-nitrocalix[4]arene |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C41H39NO12 |
| InChI |
InChI=1S/C41H39NO12/c1-8-50-41(47)35-17-31-13-27-9-21(2)11-29(37(27)51-23(4)43)15-33-19-36(42(48)49)20-34(40(33)54-26(7)46)16-30-12-22(3)10-28(38(30)52-24(5)44)14-32(18-35)39(31)53-25(6)45/h9-12,17-20H,8,13-16H2,1-7H3 |
| InChIKey |
XRDAQUJUDRBJBC-UHFFFAOYSA-N |
| Molecular Weight |
737.758 g/mol |
| SMILES |
c1(N(=O)=O)cc2Cc3c(c(Cc4cc(cc(Cc5c(c(Cc(c1)c2OC(=O)C)cc(c5)C)OC(=O)C)c4OC(=O)C)C(=O)OCC)cc(c3)C)OC(=O)C |
| SPLASH |
splash10-0600-0000096000-882f0bfee73fbb02ba44 |
| Source of Spectrum |
J-56-3376-22 |
| Synonyms |
Ethyl 25,26,27,28-tetrakis(acetyloxy)-11,23-dimethyl-17-nitropentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5-carboxylate |
| Wiley ID |
1416055 |
![25,26,27,28-Tetraacetoxy-5-(ethoxycarbonyl)-11,23-dimethyl-17-nitrocalix[4]arene](/api/spectrum/Eh25f4NSc2e/structure.png?h=300&w=458 "25,26,27,28-Tetraacetoxy-5-(ethoxycarbonyl)-11,23-dimethyl-17-nitrocalix[4]arene")
