| SpectraBase Compound ID | 2HuaeZWkTS8 |
|---|---|
| InChI | InChI=1S/C41H57N5O12/c1-36(2)18-9-10-23-38(5)13-20(48)31(41(8,56)25(49)12-24(37(3,4)55)46-34-27-33(43-16-42-27)44-17-45-34)39(38,6)14-26(50)40(23,7)19(18)11-21(32(36)54)57-35-30(53)29(52)28(51)22(15-47)58-35/h9,11,16-17,19-20,22-24,28-31,35,47-48,51-53,55-56H,10,12-15H2,1-8H3,(H2,42,43,44,45,46)/t19-,20-,22+,23+,24?,28+,29-,30+,31+,35+,38+,39-,40+,41+/m1/s1 |
| InChIKey | MREUELDSJSOJLT-RFHIVRPMSA-N |
| Mol Weight | 811.9 g/mol |
| Molecular Formula | C41H57N5O12 |
| Exact Mass | 811.400372 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 | 3hsFYxQdLCw |
|---|---|
| Name | CUCURBITAGLYCOSIDE-B;6-N-(2-BETA-D-GLUCOPYRANOSYLOXY-16-R,20-R,25-TRIHYDROXY-CUCURBITA-1,5-DIENE-3,11,22-TRIONE-24-YL)-ADENINE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H57N5O12 |
| InChI | InChI=1S/C41H57N5O12/c1-36(2)18-9-10-23-38(5)13-20(48)31(41(8,56)25(49)12-24(37(3,4)55)46-34-27-33(43-16-42-27)44-17-45-34)39(38,6)14-26(50)40(23,7)19(18)11-21(32(36)54)57-35-30(53)29(52)28(51)22(15-47)58-35/h9,11,16-17,19-20,22-24,28-31,35,47-48,51-53,55-56H,10,12-15H2,1-8H3,(H2,42,43,44,45,46)/t19-,20-,22+,23+,24?,28+,29-,30+,31+,35+,38+,39-,40+,41+/m1/s1 |
| InChIKey | MREUELDSJSOJLT-RFHIVRPMSA-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 | 811.930 g/mol |
| Sample ID | 44071 |
| Solvent | C5D5N |