| SpectraBase Compound ID | 130G2C0gmBX |
|---|---|
| InChI | InChI=1S/C41H44O19/c1-20(42)51-17-27-31-30(34(59-38(48)26-15-11-8-12-16-26)32(27)58-37(47)25-13-9-7-10-14-25)28(39(49)50-6)18-53-40(31)60-41-36(56-24(5)46)35(55-23(4)45)33(54-22(3)44)29(57-41)19-52-21(2)43/h7-16,18,27,29-36,40-41H,17,19H2,1-6H3/t27-,29+,30-,31-,32-,33+,34+,35-,36+,40+,41-/m0/s1 |
| InChIKey | YGKXLQWWUUMEHW-RAGIKJGWSA-N |
| Mol Weight | 840.8 g/mol |
| Molecular Formula | C41H44O19 |
| Exact Mass | 840.247679 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6ZZ8A676i02 |
|---|---|
| Name | 6,7-DI-O-BENZOYLNYCTANTHOSIDE-PENTAACETATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H44O19 |
| InChI | InChI=1S/C41H44O19/c1-20(42)51-17-27-31-30(34(59-38(48)26-15-11-8-12-16-26)32(27)58-37(47)25-13-9-7-10-14-25)28(39(49)50-6)18-53-40(31)60-41-36(56-24(5)46)35(55-23(4)45)33(54-22(3)44)29(57-41)19-52-21(2)43/h7-16,18,27,29-36,40-41H,17,19H2,1-6H3/t27-,29+,30-,31-,32-,33+,34+,35-,36+,40+,41-/m0/s1 |
| InChIKey | YGKXLQWWUUMEHW-RAGIKJGWSA-N |
| Literature Reference Author | H.STUPPNER,E.P.MUELLER,V.MATHURAM,A.B.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,32,375(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)94997-5 |
| Molecular Weight | 840.789 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS3635 |