| SpectraBase Spectrum ID |
1BOwv06Wo16 |
| Name |
Biscatechol THP ether |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C61H65N3O12 |
| InChI |
InChI=1S/C61H65N3O12/c65-55(31-17-34-62-60(67)51-27-15-29-53(73-43-47-19-5-1-6-20-47)58(51)75-45-49-23-9-3-10-24-49)69-40-36-64(38-42-72-57-33-13-14-39-71-57)37-41-70-56(66)32-18-35-63-61(68)52-28-16-30-54(74-44-48-21-7-2-8-22-48)59(52)76-46-50-25-11-4-12-26-50/h1-12,15-32,57H,13-14,33-46H2,(H,62,67)(H,63,68)/b31-17+,32-18+ |
| InChIKey |
JTMUGEMTDUCMQD-LTTYKRRRSA-N |
| Molecular Weight |
1032.200 g/mol |
| SMILES |
N(C(c1c(OCc2ccccc2)c(OCc2ccccc2)ccc1)=O)C\C=C\C(OCCN(CCOC(\C=C\CNC(c1c(OCc2ccccc2)c(OCc2ccccc2)ccc1)=O)=O)CCOC1OCCCC1)=O |
| SPLASH |
splash10-00mo-9045030000-d96a2e6ee2baf89247b3 |
| Source of Spectrum |
F-62-7804-15 |
| Synonyms |
2-[(2-{[(2E)-4-{[2,3-bis(benzyloxy)phenyl]formamido}but-2-enoyl]oxy}ethyl)[2-(oxan-2-yloxy)ethyl]amino]ethyl (2E)-4-{[2,3-bis(benzyloxy)phenyl]formamido}but-2-enoate |
| Wiley ID |
1640374 |
