| SpectraBase Compound ID | GHSG2oPSn7d |
|---|---|
| InChI | InChI=1S/C50H54F3NO19/c1-28(55)19-22-35(58)65-27-34-39(69-36(59)23-20-29(2)56)40(38(46(62)68-34)54-49(64)50(51,52)53)72-48-44(71-45(61)33-17-11-6-12-18-33)41(66-25-31-13-7-4-8-14-31)42(70-37(60)24-21-30(3)57)43(73-48)47(63)67-26-32-15-9-5-10-16-32/h4-18,34,38-44,46,48,62H,19-27H2,1-3H3,(H,54,64)/t34-,38-,39+,40-,41-,42-,43-,44+,46+,48+/m1/s1 |
| InChIKey | ASLKUMYIIQEVLQ-FYRVTNTGSA-N |
| Mol Weight | 1030.0 g/mol |
| Molecular Formula | C50H54F3NO19 |
| Exact Mass | 1029.324213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 63GehoGP4xP |
|---|---|
| Name | #30;3-O-(BENZYL-2-O-BENZOYL-3-O-BENZYL-4-O-LEVULINOYL-BETA-D-GLUCOPYRANOSYLURONATE)-2-DEOXY-4,6-DI-O-LEVULINOYL-2-TRIFLUOROACETAMIDO-ALPHA-D-GALACTOPYRANOSIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H54F3NO19 |
| InChI | InChI=1S/C50H54F3NO19/c1-28(55)19-22-35(58)65-27-34-39(69-36(59)23-20-29(2)56)40(38(46(62)68-34)54-49(64)50(51,52)53)72-48-44(71-45(61)33-17-11-6-12-18-33)41(66-25-31-13-7-4-8-14-31)42(70-37(60)24-21-30(3)57)43(73-48)47(63)67-26-32-15-9-5-10-16-32/h4-18,34,38-44,46,48,62H,19-27H2,1-3H3,(H,54,64)/t34-,38-,39+,40-,41-,42-,43-,44+,46+,48+/m1/s1 |
| InChIKey | ASLKUMYIIQEVLQ-FYRVTNTGSA-N |
| Literature Reference Author | G.MACCHIONE,S.MAZA,M.M.KAYSER,J.L.DEPAZ,P.M.NIETO |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,3868(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402222 |
| Molecular Weight | 1029.969 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU85334 |