| SpectraBase Spectrum ID |
JpaxMEVGBDr |
| Name |
12-[(2-hydroxy-5-phenoxyphenyl)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 |
C35H31N3O8 |
| InChI |
InChI=1S/C35H31N3O8/c39-27-13-12-24(46-23-6-2-1-3-7-23)18-22(27)19-38-16-14-36-30(40)20-44-28-10-4-8-25-32(28)35(43)33-26(34(25)42)9-5-11-29(33)45-21-31(41)37-15-17-38/h1-13,18,39H,14-17,19-21H2,(H,36,40)(H,37,41) |
| InChIKey |
YCKVGSGFOSBQSK-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP 1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.1811 |
| Molecular Weight |
621.646 g/mol |
| SMILES |
N1C(COc2cccc3c2C(c2c(cccc2OCC(=O)NCCN(Cc2c(ccc(c2)Oc2ccccc2)O)CC1)C3=O)=O)=O |
| SPLASH |
splash10-0uxr-6193100000-60e7089e4b724ae27f44 |
| Source of Spectrum |
Y-53-173-173-1 |
| Thin-Layer Chromatography |
Rf = 0.40 (EtOH/EtOAc, 1:10) |
| Wiley ID |
1877532 |
![12-[(2-hydroxy-5-phenoxyphenyl)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/JpaxMEVGBDr/structure.png?h=300&w=458 "12-[(2-hydroxy-5-phenoxyphenyl)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")
