| SpectraBase Compound ID | 4WOIRtnOb7Y |
|---|---|
| InChI | InChI=1S/C37H58O11/c1-19(38)46-26-27-32(6)12-15-37(48-32,31(4,5)43)45-18-36(27)14-13-35-17-34(35)11-10-23(47-29-25(41)24(40)20(39)16-44-29)30(2,3)21(34)8-9-22(35)33(36,7)28(26)42/h20-29,39-43H,8-18H2,1-7H3/t20-,21?,22?,23+,24+,25-,26-,27?,28-,29+,32+,33-,34-,35+,36+,37+/m1/s1 |
| InChIKey | QSNYUAFLCYWOJS-VLGNFINYSA-N |
| Mol Weight | 678.9 g/mol |
| Molecular Formula | C37H58O11 |
| Exact Mass | 678.397913 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I0m8wdyBNwE |
|---|---|
| Name | BEESIOSIDE-K;(20S,24S)-16-BETA-ACETOXY-18,24;20,24-DIEPOXY-9,19-CYCLOLANOSTANE-3-BETA,15-BETA,25-TRIOL-3-O-BETA-D-XYLOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C37H58O11 |
| InChI | InChI=1S/C37H58O11/c1-19(38)46-26-27-32(6)12-15-37(48-32,31(4,5)43)45-18-36(27)14-13-35-17-34(35)11-10-23(47-29-25(41)24(40)20(39)16-44-29)30(2,3)21(34)8-9-22(35)33(36,7)28(26)42/h20-29,39-43H,8-18H2,1-7H3/t20-,21?,22?,23+,24+,25-,26-,27?,28-,29+,32+,33-,34-,35+,36+,37+/m1/s1 |
| InChIKey | QSNYUAFLCYWOJS-VLGNFINYSA-N |
| Literature Reference Author | J.JU,D.LIU,G.LIN,Y.ZHANG,J.YANG,Y.LU,N.GONG,Q.ZHENG |
| Literature Reference Citation | J.NAT.PROD.,65,147(2002) |
| Literature Reference DOI | 10.1021/np010294h |
| Molecular Weight | 678.861 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI2752 |