| SpectraBase Compound ID | 9X1HImqPtQs |
|---|---|
| InChI | InChI=1S/C55H71NO33/c1-24(57)70-20-38-43(76-29(6)62)46(77-30(7)63)49(80-33(10)66)53(83-38)87-45-40(22-72-26(3)59)85-54(51(82-35(12)68)48(45)79-32(9)65)88-44-39(21-71-25(2)58)84-52(50(81-34(11)67)47(44)78-31(8)64)86-42-37(75-28(5)61)18-56(89-41(42)23-73-27(4)60)55(69)74-19-36-16-14-13-15-17-36/h13-17,37-54H,18-23H2,1-12H3/t37-,38-,39+,40-,41-,42+,43-,44+,45-,46+,47-,48+,49-,50+,51-,52-,53+,54+/m0/s1 |
| InChIKey | ZWVZSANZJHIWNP-DJIVSYLDSA-N |
| Mol Weight | 1274.1 g/mol |
| Molecular Formula | C55H71NO33 |
| Exact Mass | 1273.390834 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6uMflBF4bcw |
|---|---|
| Name | (4R,5S,6R)-4-ACETOXY-6-ACETOXYMETHYL-N-BENZYLOXYCARBONYL-5-[(TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1-4)-O-(TRI-O-ACETYL-BETA-D-GLUCOSYL)-(1-4)-O- |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H71NO33 |
| InChI | InChI=1S/C55H71NO33/c1-24(57)70-20-38-43(76-29(6)62)46(77-30(7)63)49(80-33(10)66)53(83-38)87-45-40(22-72-26(3)59)85-54(51(82-35(12)68)48(45)79-32(9)65)88-44-39(21-71-25(2)58)84-52(50(81-34(11)67)47(44)78-31(8)64)86-42-37(75-28(5)61)18-56(89-41(42)23-73-27(4)60)55(69)74-19-36-16-14-13-15-17-36/h13-17,37-54H,18-23H2,1-12H3/t37-,38-,39+,40-,41-,42+,43-,44+,45-,46+,47-,48+,49-,50+,51-,52-,53+,54+/m0/s1 |
| InChIKey | ZWVZSANZJHIWNP-DJIVSYLDSA-N |
| Literature Reference Author | J.M.MACDONALD,R.V.STICK,D.M.G.TILBROOK,S.G.WITHERS |
| Literature Reference Citation | AUSTR.J.CHEM.,55,747(2002) |
| Literature Reference DOI | 10.1071/CH02165 |
| Molecular Weight | 1274.156 g/mol |
| Solvent | Unknown |
| Source File Reference | UWKP3402 |