| SpectraBase Spectrum ID |
BNdpAcHU2gT |
| Name |
6-{2'-Methoxy-5'-[3''-oxo-3''-(3''',4''',5'''-trimethoxyphenyl)-prop-E1''-enyl]-phenyl}-hexyl 6-(t-butoxycarbonylaminomethyl)nicotinate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C37H46N2O10 |
| InChI |
InChI=1S/C37H46N2O10/c1-37(2,3)49-36(42)39-24-28-15-14-26(23-38-28)35(41)48-19-11-9-8-10-18-47-31-20-25(13-17-30(31)43-4)12-16-29(40)27-21-32(44-5)34(46-7)33(22-27)45-6/h12-17,20-23H,8-11,18-19,24H2,1-7H3,(H,39,42)/b16-12+ |
| InChIKey |
QVCAIYREEIXTLZ-FOWTUZBSSA-N |
| Instrument Name |
VARIAN MAT 311A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/jm801001d |
| Molecular Weight |
678.779 g/mol |
| SMILES |
N(Cc1ncc(C(OCCCCCCOc2c(ccc(c2)\C=C\C(=O)c2cc(c(c(c2)OC)OC)OC)OC)=O)cc1)C(=O)OC(C)(C)C |
| SPLASH |
splash10-052b-6900062000-40371fe1094db1e97a27 |
| Source of Spectrum |
AF-52-SM5-4c |
| Thin-Layer Chromatography |
Rf = 0.25 (ethyl acetate/hexane, 1:1) |
| Wiley ID |
1873640 |
![6-{2'-Methoxy-5'-[3''-oxo-3''-(3''',4''',5'''-trimethoxyphenyl)-prop-E1''-enyl]-phenyl}-hexyl 6-(t-butoxycarbonylaminomethyl)nicotinate](/api/spectrum/BNdpAcHU2gT/structure.png?h=300&w=458 "6-{2'-Methoxy-5'-[3''-oxo-3''-(3''',4''',5'''-trimethoxyphenyl)-prop-E1''-enyl]-phenyl}-hexyl 6-(t-butoxycarbonylaminomethyl)nicotinate")
