| SpectraBase Compound ID | 5nwZY6BSt5V |
|---|---|
| InChI | InChI=1S/C42H50O16/c1-49-29-11-21(7-9-27(29)43)37(45)35-19-57-41(23-13-31(51-3)39(47)32(14-23)52-4)25(17-55-35)26-18-56-36(38(46)22-8-10-28(44)30(12-22)50-2)20-58-42(26)24-15-33(53-5)40(48)34(16-24)54-6/h7-16,25-26,35-38,41-48H,17-20H2,1-6H3/t25-,26+,35+,36-,37?,38?,41+,42- |
| InChIKey | LXZQSRKEZKPRBC-QZBCEXSWSA-N |
| Mol Weight | 810.8 g/mol |
| Molecular Formula | C42H50O16 |
| Exact Mass | 810.309886 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IVZkWf4JpdX |
|---|---|
| Name | PHYLLOSTADIMER-B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H50O16 |
| InChI | InChI=1S/C42H50O16/c1-49-29-11-21(7-9-27(29)43)37(45)35-19-57-41(23-13-31(51-3)39(47)32(14-23)52-4)25(17-55-35)26-18-56-36(38(46)22-8-10-28(44)30(12-22)50-2)20-58-42(26)24-15-33(53-5)40(48)34(16-24)54-6/h7-16,25-26,35-38,41-48H,17-20H2,1-6H3/t25-,26+,35+,36-,37?,38?,41+,42- |
| InChIKey | LXZQSRKEZKPRBC-QZBCEXSWSA-N |
| Literature Reference Author | A.SUGA,Y.TAKAISHI,S.GOTO,T.MUNAKATA,I.YAMAUCHI,K.KOGURE |
| Literature Reference Citation | PHYTOCHEM.,64,991(2003) |
| Literature Reference DOI | 10.1016/S0031-9422(03)00422-9 |
| Molecular Weight | 810.849 g/mol |
| Solvent | Unknown |
| Source File Reference | UWKP5683 |