| SpectraBase Compound ID | 50t7OhHnqiv |
|---|---|
| InChI | InChI=1S/C46H65N5O16/c1-41(2)19-9-10-25-43(5)13-21(54)35(44(43,6)14-28(56)45(25,7)20(19)11-22(36(41)62)66-40-34(61)32(59)30(57)24(16-53)67-40)46(8,64)27(55)12-26(42(3,4)63)50-37-29-38(48-17-47-37)51(18-49-29)39-33(60)31(58)23(15-52)65-39/h9,11,17-18,20-21,23-26,30-35,39-40,52-54,57-61,63-64H,10,12-16H2,1-8H3,(H,47,48,50)/t20-,21-,23-,24+,25+,26?,30+,31-,32-,33-,34+,35+,39-,40+,43+,44-,45+,46+/m1/s1 |
| InChIKey | URTOXXGIVHAQEK-DLUXORBTSA-N |
| Mol Weight | 944.0 g/mol |
| Molecular Formula | C46H65N5O16 |
| Exact Mass | 943.442631 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 29zkWSDlUzt |
|---|---|
| Name | CUCURBITAGLYCOSIDE-A;6-N-(2-BETA-D-GLUCOPYRANOSYLOXY-16-R,20-R,25-TRIHYDROXY-CUCURBITA-1,5-DIENE-3,11,22-TRIONE-24-YL)-ADENOSINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H65N5O16 |
| InChI | InChI=1S/C46H65N5O16/c1-41(2)19-9-10-25-43(5)13-21(54)35(44(43,6)14-28(56)45(25,7)20(19)11-22(36(41)62)66-40-34(61)32(59)30(57)24(16-53)67-40)46(8,64)27(55)12-26(42(3,4)63)50-37-29-38(48-17-47-37)51(18-49-29)39-33(60)31(58)23(15-52)65-39/h9,11,17-18,20-21,23-26,30-35,39-40,52-54,57-61,63-64H,10,12-16H2,1-8H3,(H,47,48,50)/t20-,21-,23-,24+,25+,26?,30+,31-,32-,33-,34+,35+,39-,40+,43+,44-,45+,46+/m1/s1 |
| InChIKey | URTOXXGIVHAQEK-DLUXORBTSA-N |
| Literature Reference Author | D.C.WANG,H.XIANG,D.LI,H.Y.GAO,H.CAI,L.J.WU,X.M.DENG |
| Literature Reference Citation | PHYTOCHEM.,69,1434(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.01.019 |
| Molecular Weight | 944.046 g/mol |
| Sample ID | 44070 |
| Solvent | C5D5N |