![(22-S,25-S)-26-O-BETA-D-GLUCOPYRANOSYL-22,25-EPOXYFUROST-5-EN-3-BETA,26-DIOL_3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/4GeLdu7bHTL/structure.png?h=300&w=458 "(22-S,25-S)-26-O-BETA-D-GLUCOPYRANOSYL-22,25-EPOXYFUROST-5-EN-3-BETA,26-DIOL_3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | AcnPsCRz50E |
|---|---|
| InChI | InChI=1S/C45H72O18/c1-19-29-26(62-45(19)13-12-42(3,63-45)18-56-39-36(54)34(52)31(49)27(16-46)59-39)15-25-23-7-6-21-14-22(8-10-43(21,4)24(23)9-11-44(25,29)5)58-41-38(35(53)32(50)28(17-47)60-41)61-40-37(55)33(51)30(48)20(2)57-40/h6,19-20,22-41,46-55H,7-18H2,1-5H3/t19-,20-,22-,23+,24-,25-,26-,27+,28+,29-,30-,31+,32+,33+,34-,35-,36+,37+,38+,39+,40-,41+,42-,43-,44-,45-/m0/s1 |
| InChIKey | ITLGIRYNBZIFPE-SJKAGGRQSA-N |
| Mol Weight | 901.1 g/mol |
| Molecular Formula | C45H72O18 |
| Exact Mass | 900.471865 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GeLdu7bHTL |
|---|---|
| Name | (22-S,25-S)-26-O-BETA-D-GLUCOPYRANOSYL-22,25-EPOXYFUROST-5-EN-3-BETA,26-DIOL_3-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 12 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H72O18 |
| InChI | InChI=1S/C45H72O18/c1-19-29-26(62-45(19)13-12-42(3,63-45)18-56-39-36(54)34(52)31(49)27(16-46)59-39)15-25-23-7-6-21-14-22(8-10-43(21,4)24(23)9-11-44(25,29)5)58-41-38(35(53)32(50)28(17-47)60-41)61-40-37(55)33(51)30(48)20(2)57-40/h6,19-20,22-41,46-55H,7-18H2,1-5H3/t19-,20-,22-,23+,24-,25-,26-,27+,28+,29-,30-,31+,32+,33+,34-,35-,36+,37+,38+,39+,40-,41+,42-,43-,44-,45-/m0/s1 |
| InChIKey | ITLGIRYNBZIFPE-SJKAGGRQSA-N |
| Literature Reference Author | Y.MIMAKI,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,29,2267(1990) |
| Literature Reference DOI | 10.1016/0031-9422(90)83050-B |
| Molecular Weight | 901.056 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ22447 |