| SpectraBase Compound ID | 2AmDTXKQO9O |
|---|---|
| InChI | InChI=1S/C56H40O12/c57-30-9-1-25(2-10-30)52-44(29-17-34(61)19-35(62)18-29)51-43(67-52)24-40-48-45-38(20-36(63)22-41(45)66-54(48)27-5-13-32(59)14-6-27)47-46-39(49-50(40)56(51)68-55(49)28-7-15-33(60)16-8-28)21-37(64)23-42(46)65-53(47)26-3-11-31(58)12-4-26/h1-24,44,47-49,52-55,57-64H/t44-,47-,48+,49+,52+,53+,54-,55-/m1/s1 |
| InChIKey | RKUIZKULTFDMTQ-NPFBEZPKSA-N |
| Mol Weight | 904.9 g/mol |
| Molecular Formula | C56H40O12 |
| Exact Mass | 904.251977 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LoRGwDfqfcA |
|---|---|
| Name | DAVIDIOL-C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H40O12 |
| InChI | InChI=1S/C56H40O12/c57-30-9-1-25(2-10-30)52-44(29-17-34(61)19-35(62)18-29)51-43(67-52)24-40-48-45-38(20-36(63)22-41(45)66-54(48)27-5-13-32(59)14-6-27)47-46-39(49-50(40)56(51)68-55(49)28-7-15-33(60)16-8-28)21-37(64)23-42(46)65-53(47)26-3-11-31(58)12-4-26/h1-24,44,47-49,52-55,57-64H/t44-,47-,48+,49+,52+,53+,54-,55-/m1/s1 |
| InChIKey | RKUIZKULTFDMTQ-NPFBEZPKSA-N |
| Literature Reference Author | T.TANAKA,T.ITO,M.IINUMA,M.OHYAMA,M.ICHISE,Y.TATEISHI |
| Literature Reference Citation | PHYTOCHEM.,53,1009(2000) |
| Literature Reference DOI | 10.1016/S0031-9422(00)00016-9 |
| Molecular Weight | 904.926 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWLU2277 |