| SpectraBase Compound ID | 3qKrtLYyBeZ |
|---|---|
| InChI | InChI=1S/C41H70O13/c1-20(2)10-9-13-41(8,54-35-32(49)29(46)23(44)19-51-35)21-11-15-39(6)28(21)22(43)16-26-38(5)14-12-27(45)37(3,4)34(38)24(17-40(26,39)7)52-36-33(50)31(48)30(47)25(18-42)53-36/h10,21-36,42-50H,9,11-19H2,1-8H3/t21-,22+,23-,24-,25-,26+,27-,28-,29-,30-,31+,32+,33-,34-,35-,36-,38+,39+,40+,41-/m0/s1 |
| InChIKey | ODYGBKNRTQIFGD-YEXQXPIKSA-N |
| Mol Weight | 771.0 g/mol |
| Molecular Formula | C41H70O13 |
| Exact Mass | 770.481642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IobhqZZh0vE |
|---|---|
| Name | (20S)-SANCHIRHINOSIDE-A3 |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H70O13 |
| InChI | InChI=1S/C41H70O13/c1-20(2)10-9-13-41(8,54-35-32(49)29(46)23(44)19-51-35)21-11-15-39(6)28(21)22(43)16-26-38(5)14-12-27(45)37(3,4)34(38)24(17-40(26,39)7)52-36-33(50)31(48)30(47)25(18-42)53-36/h10,21-36,42-50H,9,11-19H2,1-8H3/t21-,22+,23-,24-,25-,26+,27-,28-,29-,30-,31+,32+,33-,34-,35-,36-,38+,39+,40+,41-/m0/s1 |
| InChIKey | ODYGBKNRTQIFGD-YEXQXPIKSA-N |
| Literature Reference Author | Y.ZHANG,L.F.HAN,K.J.SAKAH,Z.Z.WU,L.L.LIU,K.AGYEMANG,X.M.GAO, T.WANG |
| Literature Reference Citation | MOLECULES,18,10352(2013) |
| Literature Reference DOI | 10.3390/molecules180910352 |
| Molecular Weight | 770.999 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWIR9304 |