| SpectraBase Compound ID | 7JILCQVqbGn |
|---|---|
| InChI | InChI=1S/C27H32O12/c28-11-19-22(31)23(32)24(33)27(38-19)39-26-21-15(7-9-17(21)18(13-37-26)25(34)35)12-36-20(30)10-16(29)8-6-14-4-2-1-3-5-14/h1-8,13,16-17,19,21-24,26-29,31-33H,9-12H2,(H,34,35)/b8-6+/t16-,17+,19-,21+,22-,23+,24-,26-,27+/m0/s1 |
| InChIKey | UNWQLXACHOFSIS-NEJBLJGMSA-N |
| Mol Weight | 548.5 g/mol |
| Molecular Formula | C27H32O12 |
| Exact Mass | 548.189376 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8TlQGvNhLbB |
|---|---|
| Name | MARINOID-E |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H32O12 |
| InChI | InChI=1S/C27H32O12/c28-11-19-22(31)23(32)24(33)27(38-19)39-26-21-15(7-9-17(21)18(13-37-26)25(34)35)12-36-20(30)10-16(29)8-6-14-4-2-1-3-5-14/h1-8,13,16-17,19,21-24,26-29,31-33H,9-12H2,(H,34,35)/b8-6+/t16-,17+,19-,21+,22-,23+,24-,26-,27+/m0/s1 |
| InChIKey | UNWQLXACHOFSIS-NEJBLJGMSA-N |
| Literature Reference Author | Y.SUN,J.OUYANG,Z.DENG,Q.LI,W.LIN |
| Literature Reference Citation | MAGN.RES.CHEM.,46,638(2008) |
| Literature Reference DOI | 10.1002/mrc.2224 |
| Molecular Weight | 548.544 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU82566 |