| SpectraBase Compound ID | JoSmF2nW7Ks |
|---|---|
| InChI | InChI=1S/C52H80O11/c1-8-10-12-14-16-18-20-21-22-24-26-28-30-32-41(54)58-35-48-45(60-48)42-46-51(36(3)4)44(59-39(7)53)38(6)52(42,40-34-37(5)43(55)50(40,57)47(48)56)63-49(61-46,62-51)33-31-29-27-25-23-19-17-15-13-11-9-2/h27,29,31,33-34,38,40,42,44-47,56-57H,3,8-26,28,30,32,35H2,1-2,4-7H3/b29-27+,33-31+/t38-,40-,42+,44-,45+,46-,47-,48+,49-,50-,51+,52+/m1/s1 |
| InChIKey | CQAGSPJZGPVEHB-VUTSTSBDSA-N |
| Mol Weight | 881.2 g/mol |
| Molecular Formula | C52H80O11 |
| Exact Mass | 880.570063 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DirrmRaWtr6 |
|---|---|
| Name | WIKSTROELIDE-D |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H80O11 |
| InChI | InChI=1S/C52H80O11/c1-8-10-12-14-16-18-20-21-22-24-26-28-30-32-41(54)58-35-48-45(60-48)42-46-51(36(3)4)44(59-39(7)53)38(6)52(42,40-34-37(5)43(55)50(40,57)47(48)56)63-49(61-46,62-51)33-31-29-27-25-23-19-17-15-13-11-9-2/h27,29,31,33-34,38,40,42,44-47,56-57H,3,8-26,28,30,32,35H2,1-2,4-7H3/b29-27+,33-31+/t38-,40-,42+,44-,45+,46-,47-,48+,49-,50-,51+,52+/m1/s1 |
| InChIKey | CQAGSPJZGPVEHB-VUTSTSBDSA-N |
| Literature Reference Author | F.ABE,Y.IWASE,T.YAMAUCHI,K.KINJO,S.YAGA |
| Literature Reference Citation | PHYTOCHEM.,44,643(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00602-4 |
| Molecular Weight | 881.201 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWPA204 |