![(25S)-27-HYDROXY-SPIROST-5-EN-3-BETA-YL-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE](/api/spectrum/HFDKkY4z4ms/structure.png?h=300&w=458 "(25S)-27-HYDROXY-SPIROST-5-EN-3-BETA-YL-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | I8I3ujI77R7 |
|---|---|
| InChI | InChI=1S/C45H72O18/c1-19-30-27(63-45(19)12-7-21(15-46)17-57-45)14-26-24-6-5-22-13-23(8-10-43(22,3)25(24)9-11-44(26,30)4)59-42-39(62-41-38(55)34(51)31(48)20(2)58-41)36(53)33(50)29(61-42)18-56-40-37(54)35(52)32(49)28(16-47)60-40/h5,19-21,23-42,46-55H,6-18H2,1-4H3/t19-,20-,21+,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 | KLPGHLHMPHUYIW-YCIYUFLKSA-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 | HFDKkY4z4ms |
|---|---|
| Name | (25S)-27-HYDROXY-SPIROST-5-EN-3-BETA-YL-O-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-O-[BETA-D-GLUCOPYRANOSYL-(1->6)]-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H72O18 |
| InChI | InChI=1S/C45H72O18/c1-19-30-27(63-45(19)12-7-21(15-46)17-57-45)14-26-24-6-5-22-13-23(8-10-43(22,3)25(24)9-11-44(26,30)4)59-42-39(62-41-38(55)34(51)31(48)20(2)58-41)36(53)33(50)29(61-42)18-56-40-37(54)35(52)32(49)28(16-47)60-40/h5,19-21,23-42,46-55H,6-18H2,1-4H3/t19-,20-,21+,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 | KLPGHLHMPHUYIW-YCIYUFLKSA-N |
| Literature Reference Author | Y.MIMAKI,T.SATOU,M.KURODA,Y.SASHIDA,Y.HATAKEYAMA |
| Literature Reference Citation | PHYTOCHEM.,51,567(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00022-9 |
| Molecular Weight | 901.056 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWUC396 |