| SpectraBase Compound ID | 6edsoTSTC6E |
|---|---|
| InChI | InChI=1S/C42H72O14/c1-20(9-13-29(39(4,5)52)56-37-35(51)33(49)31(47)25(19-44)54-37)21-15-16-40(6)26-12-10-22-23(42(26,8)27(45)17-41(21,40)7)11-14-28(38(22,2)3)55-36-34(50)32(48)30(46)24(18-43)53-36/h10,20-21,23-37,43-52H,9,11-19H2,1-8H3/t20?,21-,23-,24-,25+,26+,27-,28+,29+,30-,31+,32+,33-,34-,35+,36+,37-,40+,41-,42+/m1/s1 |
| InChIKey | WVXIMWMLKSCVTD-OKNNPIIYSA-N |
| Mol Weight | 801.0 g/mol |
| Molecular Formula | C42H72O14 |
| Exact Mass | 800.492207 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7aLDQerUThF |
|---|---|
| Name | MOGROSIDE-IIE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H72O14 |
| InChI | InChI=1S/C42H72O14/c1-20(9-13-29(39(4,5)52)56-37-35(51)33(49)31(47)25(19-44)54-37)21-15-16-40(6)26-12-10-22-23(42(26,8)27(45)17-41(21,40)7)11-14-28(38(22,2)3)55-36-34(50)32(48)30(46)24(18-43)53-36/h10,20-21,23-37,43-52H,9,11-19H2,1-8H3/t20?,21-,23-,24-,25+,26+,27-,28+,29+,30-,31+,32+,33-,34-,35+,36+,37-,40+,41-,42+/m1/s1 |
| InChIKey | WVXIMWMLKSCVTD-OKNNPIIYSA-N |
| Literature Reference Author | D.LI,T.IKEDA,N.MATSUOKA,T.NOHARA,H.ZHANG,T.SAKAMOTO,G.I.NONA KA |
| Literature Reference Citation | CHEM.PHARM.BULL.,54,1425(2006) |
| Literature Reference DOI | 10.1248/cpb.54.1425 |
| Molecular Weight | 801.025 g/mol |
| Sample ID | 55263 |
| Solvent | C5D5N |