| SpectraBase Spectrum ID |
3NwIL2vMehj |
| Name |
2-[(Trifluoroacetoamido)ethyl] 2,2',3,,6,6'-penta - O-benzyl-3',4'-O-isopropylidene-.beta.-D-lactoside |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C54H60F3NO12 |
| InChI |
InChI=1S/C54H60F3NO12/c1-53(2)69-45-43(36-61-31-38-20-10-4-11-21-38)67-51(49(47(45)70-53)65-34-41-26-16-7-17-27-41)68-44-42(35-60-30-37-18-8-3-9-19-37)66-50(62-29-28-58-52(59)54(55,56)57)48(64-33-40-24-14-6-15-25-40)46(44)63-32-39-22-12-5-13-23-39/h3-27,42-51H,28-36H2,1-2H3,(H,58,59)/t42-,43-,44-,45+,46+,47+,48-,49-,50-,51+/m1/s1 |
| InChIKey |
ZCDZVJNBQUJSKO-JNUFLZOISA-N |
| Molecular Weight |
972.064 g/mol |
| SMILES |
N(C(C(F)(F)F)=O)CCO[C@@]1(O[C@@]([C@]([C@@]([C@]1(OCc1ccccc1)[H])(OCc1ccccc1)[H])(O[C@]1([C@@]([C@@]2([C@@](OC(O2)(C)C)([C@@](COCc2ccccc2)(O1)[H])[H])[H])(OCc1ccccc1)[H])[H])[H])(COCc1ccccc1)[H])[H] |
| SPLASH |
splash10-00di-0000000009-b127a661a762dc396a52 |
| Source of Spectrum |
QF-49-1308-10 |
| Wiley ID |
834122 |
![2-[(Trifluoroacetoamido)ethyl] 2,2',3,,6,6'-penta - O-benzyl-3',4'-O-isopropylidene-.beta.-D-lactoside](/api/spectrum/3NwIL2vMehj/structure.png?h=300&w=458 "2-[(Trifluoroacetoamido)ethyl] 2,2',3,,6,6'-penta - O-benzyl-3',4'-O-isopropylidene-.beta.-D-lactoside")
