![PRIMULANIN;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-CYCLAMIRETIN-A](/api/spectrum/3fyVHUYsZlZ/structure.png?h=300&w=458 "PRIMULANIN;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-CYCLAMIRETIN-A")
| SpectraBase Compound ID | 7qZWyIaaIWC |
|---|---|
| InChI | InChI=1S/C46H74O17/c1-40(2)25-7-11-43(5)26(8-12-46-27-15-41(3,20-48)13-14-45(27,21-59-46)28(50)16-44(43,46)6)42(25,4)10-9-29(40)62-37-35(56)32(53)24(19-58-37)61-39-36(33(54)31(52)23(17-47)60-39)63-38-34(55)30(51)22(49)18-57-38/h20,22-39,47,49-56H,7-19,21H2,1-6H3/t22-,23-,24+,25+,26-,27-,28-,29+,30+,31-,32+,33+,34-,35-,36-,37+,38+,39+,41+,42+,43-,44+,45-,46+/m1/s1 |
| InChIKey | JFAKXPCWZPQXLP-KASLOCEDSA-N |
| Mol Weight | 899.1 g/mol |
| Molecular Formula | C46H74O17 |
| Exact Mass | 898.492601 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3fyVHUYsZlZ |
|---|---|
| Name | PRIMULANIN;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-CYCLAMIRETIN-A |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H74O17 |
| InChI | InChI=1S/C46H74O17/c1-40(2)25-7-11-43(5)26(8-12-46-27-15-41(3,20-48)13-14-45(27,21-59-46)28(50)16-44(43,46)6)42(25,4)10-9-29(40)62-37-35(56)32(53)24(19-58-37)61-39-36(33(54)31(52)23(17-47)60-39)63-38-34(55)30(51)22(49)18-57-38/h20,22-39,47,49-56H,7-19,21H2,1-6H3/t22-,23-,24+,25+,26-,27-,28-,29+,30+,31-,32+,33+,34-,35-,36-,37+,38+,39+,41+,42+,43-,44+,45-,46+/m1/s1 |
| InChIKey | JFAKXPCWZPQXLP-KASLOCEDSA-N |
| Literature Reference Author | C.LAVAUD,G.MASSIOT,J.B.BARRERA,C.MORETTI,L.L.MEN-OLIVIER |
| Literature Reference Citation | PHYTOCHEM.,37,1671(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89590-4 |
| Molecular Weight | 899.083 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS6435 |