| SpectraBase Compound ID | Bbxresn9vMn |
|---|---|
| InChI | InChI=1S/C55H76FNO21/c1-28-39(71-30(3)59)43(72-31(4)60)44(67-25-32-21-23-34(65-14)24-22-32)48(70-28)76-42-38(57-29(2)58)47(66-15)74-36(27-68-46(61)33-19-17-16-18-20-33)40(42)75-49-45(78-52(64)55(11,12)13)41(77-51(63)54(8,9)10)37(56)35(73-49)26-69-50(62)53(5,6)7/h16-24,28,35-45,47-49H,25-27H2,1-15H3,(H,57,58)/t28-,35-,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,47-,48-,49+/m1/s1 |
| InChIKey | RZHIDPPYOMVVFU-SCNNHYHQSA-N |
| Mol Weight | 1106.2 g/mol |
| Molecular Formula | C55H76FNO21 |
| Exact Mass | 1105.489387 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4MxXcwcwaRN |
|---|---|
| Name | #28;METHYL-2-ACETAMIDO-3-O-(3,4-DI-O-ACETYL-2-O-PARA-METHOXYBENZYL-ALPHA-L-FUCOPYRANOSYL)-6-O-BENZOYL-2-DEOXY-4-O-(4-DEOXY-4-FLUORO-2,3,6-TRI-O-PIVALOYL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H76FNO21 |
| InChI | InChI=1S/C55H76FNO21/c1-28-39(71-30(3)59)43(72-31(4)60)44(67-25-32-21-23-34(65-14)24-22-32)48(70-28)76-42-38(57-29(2)58)47(66-15)74-36(27-68-46(61)33-19-17-16-18-20-33)40(42)75-49-45(78-52(64)55(11,12)13)41(77-51(63)54(8,9)10)37(56)35(73-49)26-69-50(62)53(5,6)7/h16-24,28,35-45,47-49H,25-27H2,1-15H3,(H,57,58)/t28-,35-,36-,37+,38-,39+,40-,41+,42-,43+,44-,45-,47-,48-,49+/m1/s1 |
| InChIKey | RZHIDPPYOMVVFU-SCNNHYHQSA-N |
| Literature Reference Author | C.J.MOORE,F.I.AUZANNEAU |
| Literature Reference Citation | BEIL.J.ORG.CHEM.,8,1134(2012) |
| Literature Reference DOI | 10.3762/bjoc.8.126 |
| Molecular Weight | 1106.201 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWIR10940 |