| SpectraBase Spectrum ID |
2SNeNONT9gd |
| Name |
12-{[2-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]methyl}-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone |
| Appearance |
Yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H33N3O8 |
| InChI |
InChI=1S/C33H33N3O8/c1-3-6-20-15-21(31(39)26(16-20)42-2)17-36-13-11-34-27(37)18-43-24-9-4-7-22-29(24)33(41)30-23(32(22)40)8-5-10-25(30)44-19-28(38)35-12-14-36/h3-5,7-10,15-16,39H,1,6,11-14,17-19H2,2H3,(H,34,37)(H,35,38) |
| InChIKey |
UWNCERFFPHEPGP-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.1811 |
| Molecular Weight |
599.640 g/mol |
| SMILES |
N1C(COc2cccc3c2C(c2c(cccc2OCC(=O)NCCN(Cc2c(c(cc(c2)CC=C)OC)O)CC1)C3=O)=O)=O |
| SPLASH |
splash10-0uxr-4194110000-31ea66b40b66ade5fb1b |
| Source of Spectrum |
Y-53-172-172-1 |
| Thin-Layer Chromatography |
Rf = 0.50 (EtOH/EtOAc, 1:10) |
| Wiley ID |
1877523 |
![12-{[2-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]methyl}-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone](/api/spectrum/2SNeNONT9gd/structure.png?h=300&w=458 "12-{[2-hydroxy-3-methoxy-5-(prop-2-en-1-yl)phenyl]methyl}-6,18-dioxa-9,12,15-triazatetracyclo[21.3.1.0(5,26).0(19,24)]heptacosa-1(26),2,4,19,21,23-hexaene-8,16,25,27-tetrone")
