| SpectraBase Compound ID | E8z8jOEIo0b |
|---|---|
| InChI | InChI=1S/C28H37ClO14/c1-10-25(35)43-22-18(29)15(9-30)19-20(42-19)23(40-13(4)33)26(6)16(38-11(2)31)8-17(39-12(3)32)27(7,36)21(26)24(28(10,22)37)41-14(5)34/h10,16-17,19-24,30,36-37H,8-9H2,1-7H3/b18-15+/t10-,16-,17+,19+,20+,21+,22-,23-,24-,26-,27+,28-/m0/s1 |
| InChIKey | FGGARRZISMNPTH-BBQUAXPISA-N |
| Mol Weight | 633.0 g/mol |
| Molecular Formula | C28H37ClO14 |
| Exact Mass | 632.187184 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bw61QSXIA0b |
|---|---|
| Name | BRIAREIN-F |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H37ClO14 |
| InChI | InChI=1S/C28H37ClO14/c1-10-25(35)43-22-18(29)15(9-30)19-20(42-19)23(40-13(4)33)26(6)16(38-11(2)31)8-17(39-12(3)32)27(7,36)21(26)24(28(10,22)37)41-14(5)34/h10,16-17,19-24,30,36-37H,8-9H2,1-7H3/b18-15+/t10-,16-,17+,19+,20+,21+,22-,23-,24-,26-,27+,28-/m0/s1 |
| InChIKey | FGGARRZISMNPTH-BBQUAXPISA-N |
| Literature Reference Author | A.D.RODRIGUEZ,C.RAMIREZ,O.M.COBAR |
| Literature Reference Citation | J.NAT.PROD.,59,15(1996) |
| Literature Reference DOI | 10.1021/np960001y |
| Molecular Weight | 633.046 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVP872 |