| SpectraBase Compound ID | COF8IjtcRlz |
|---|---|
| InChI | InChI=1S/C45H44O9/c1-23(2)7-10-26-19-28(12-17-34(26)47)45-40(41(50)32-20-27(11-8-24(3)4)36(49)22-38(32)53-45)39-31-15-13-29(46)21-37(31)51-43-44(39,54-45)33-16-18-35(48)30(42(33)52-43)14-9-25(5)6/h7-9,12-13,15-22,39-40,43,46-49H,10-11,14H2,1-6H3/t39-,40-,43-,44+,45-/m1/s1 |
| InChIKey | IUNNUKJWKPJUCQ-AHJAKLPMSA-N |
| Mol Weight | 728.8 g/mol |
| Molecular Formula | C45H44O9 |
| Exact Mass | 728.298533 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DD7FJjxkphS |
|---|---|
| Name | LICOAGRODIN |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H44O9 |
| InChI | InChI=1S/C45H44O9/c1-23(2)7-10-26-19-28(12-17-34(26)47)45-40(41(50)32-20-27(11-8-24(3)4)36(49)22-38(32)53-45)39-31-15-13-29(46)21-37(31)51-43-44(39,54-45)33-16-18-35(48)30(42(33)52-43)14-9-25(5)6/h7-9,12-13,15-22,39-40,43,46-49H,10-11,14H2,1-6H3/t39-,40-,43-,44+,45-/m1/s1 |
| InChIKey | IUNNUKJWKPJUCQ-AHJAKLPMSA-N |
| Literature Reference Author | W.LI,Y.ASADA,T.YOSHIKAWA |
| Literature Reference Citation | PHYTOCHEM.,55,447(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00337-X |
| Molecular Weight | 728.839 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWLU2519 |