| SpectraBase Spectrum ID |
2YEKUzXnbkq |
| Name |
5,11,17,23-Tetra-tert-butyl-25,26,27-tris[(2-pyridylmethyl)oxy]-28-hydroxycalix[4]arene, partial cone comformer |
| CAS Registry Number |
123239-32-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C62H71N3O4 |
| InChI |
InChI=1S/C62H71N3O4/c1-59(2,3)48-29-40-25-42-31-49(60(4,5)6)33-44(56(42)67-37-52-19-13-16-22-63-52)27-46-35-51(62(10,11)12)36-47(58(46)69-39-54-21-15-18-24-65-54)28-45-34-50(61(7,8)9)32-43(26-41(30-48)55(40)66)57(45)68-38-53-20-14-17-23-64-53/h13-24,29-36,66H,25-28,37-39H2,1-12H3 |
| InChIKey |
SIYGDFMMBMDHJB-UHFFFAOYSA-N |
| Molecular Weight |
922.267 g/mol |
| SMILES |
Oc1c2Cc3c(c(Cc4c(c(Cc5c(c(Cc1cc(c2)C(C)(C)C)cc(c5)C(C)(C)C)OCc1ncccc1)cc(c4)C(C)(C)C)OCc1ncccc1)cc(c3)C(C)(C)C)OCc1ncccc1 |
| SPLASH |
splash10-00b9-0000001396-c827103b36544557a20f |
| Source of Spectrum |
J-57-2622-2 |
| Synonyms |
5,11,17,23-Tetra-tert-butyl-25,26,27-tris[(2-pyridylmethyl)oxy]-28-hydroxycalix[4]arene, cone comformer
5,11,17,23-tetra-tert-butyl-26,27,28-tris(pyridin-2-ylmethoxy)pentacyclo[19.3.1.1(3,7).1(9,13).1(15,19)]octacosa-1(25),3,5,7(28),9,11,13(27),15(26),16,18,21,23-dodecaen-25-ol |
| Wiley ID |
1418140 |
![5,11,17,23-Tetra-tert-butyl-25,26,27-tris[(2-pyridylmethyl)oxy]-28-hydroxycalix[4]arene, partial cone comformer](/api/spectrum/2YEKUzXnbkq/structure.png?h=300&w=458 "5,11,17,23-Tetra-tert-butyl-25,26,27-tris[(2-pyridylmethyl)oxy]-28-hydroxycalix[4]arene, partial cone comformer")
