| SpectraBase Compound ID | BWvnN9eYTK8 |
|---|---|
| InChI | InChI=1S/C31H46O13/c1-16-10-11-24(31(8,9)37)25(14-17(2)13-23(12-16)39-19(4)33)43-30-29(42-22(7)36)28(41-21(6)35)27(40-20(5)34)26(44-30)15-38-18(3)32/h12,14,23-30,37H,10-11,13,15H2,1-9H3/b16-12+,17-14+/t23-,24+,25-,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | CYYSSBXWOLRUQF-OGPNBBALSA-N |
| Mol Weight | 626.7 g/mol |
| Molecular Formula | C31H46O13 |
| Exact Mass | 626.293842 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LUJVue2gXh6 |
|---|---|
| Name | TRANS,TRANS-1(10),4-GERMACRADIENE-6-O-BETA-GLUCOPYRANOSYL-TETRAACETATE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H46O13 |
| InChI | InChI=1S/C31H46O13/c1-16-10-11-24(31(8,9)37)25(14-17(2)13-23(12-16)39-19(4)33)43-30-29(42-22(7)36)28(41-21(6)35)27(40-20(5)34)26(44-30)15-38-18(3)32/h12,14,23-30,37H,10-11,13,15H2,1-9H3/b16-12+,17-14+/t23-,24+,25-,26+,27+,28-,29+,30+/m0/s1 |
| InChIKey | CYYSSBXWOLRUQF-OGPNBBALSA-N |
| Literature Reference Author | W.KISIEL,Z.JANECZKO,M.ZGUD-WALASZEK |
| Literature Reference Citation | PHYTOCHEM.,49,2031(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00399-9 |
| Molecular Weight | 626.698 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU832 |