![9,11-DEHYDROMANOGENIN-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSIDE]](/api/spectrum/EriLDe6Vcl9/structure.png?h=300&w=458 "9,11-DEHYDROMANOGENIN-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSIDE]")
| SpectraBase Compound ID | Kr3UEjDxRh2 |
|---|---|
| InChI | InChI=1S/C45H70O20/c1-17-7-8-45(58-16-17)18(2)30-25(65-45)10-22-20-6-5-19-9-24(23(49)12-43(19,3)21(20)11-29(50)44(22,30)4)59-40-37(57)35(55)38(28(15-48)62-40)63-42-39(34(54)32(52)27(14-47)61-42)64-41-36(56)33(53)31(51)26(13-46)60-41/h11,17-20,22-28,30-42,46-49,51-57H,5-10,12-16H2,1-4H3/t17-,18-,19?,20?,22-,23+,24+,25?,26+,27+,28-,30?,31+,32+,33-,34-,35-,36+,37-,38+,39+,40-,41-,42-,43-,44+,45+/m0/s1 |
| InChIKey | OUBRFERAJRPHGE-OXWQXNECSA-N |
| Mol Weight | 931.0 g/mol |
| Molecular Formula | C45H70O20 |
| Exact Mass | 930.446045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EriLDe6Vcl9 |
|---|---|
| Name | 9,11-DEHYDROMANOGENIN-3-O-[O-BETA-D-GLUCOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GALACTOPYRANOSIDE] |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H70O20 |
| InChI | InChI=1S/C45H70O20/c1-17-7-8-45(58-16-17)18(2)30-25(65-45)10-22-20-6-5-19-9-24(23(49)12-43(19,3)21(20)11-29(50)44(22,30)4)59-40-37(57)35(55)38(28(15-48)62-40)63-42-39(34(54)32(52)27(14-47)61-42)64-41-36(56)33(53)31(51)26(13-46)60-41/h11,17-20,22-28,30-42,46-49,51-57H,5-10,12-16H2,1-4H3/t17-,18-,19?,20?,22-,23+,24+,25?,26+,27+,28-,30?,31+,32+,33-,34-,35-,36+,37-,38+,39+,40-,41-,42-,43-,44+,45+/m0/s1 |
| InChIKey | OUBRFERAJRPHGE-OXWQXNECSA-N |
| Literature Reference Author | Y.MIMAKI,M.KURODA,A.KAMEYAMA,A.YOKOSUKA,Y.SASHIDA |
| Literature Reference Citation | PHYTOCHEM.,48,1361(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00157-5 |
| Molecular Weight | 931.039 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1479 |