| SpectraBase Compound ID | FnA2f9mwMrz |
|---|---|
| InChI | InChI=1S/C57H100O20/c1-9-12-14-15-16-17-20-23-27-31-39(58)72-50-45(64)55(69-36(7)48(50)75-54-44(63)43(62)47(35(6)68-54)74-53(66)33(4)11-3)76-49-37(8)70-56-46(65)51(49)73-40(59)32-28-24-21-18-19-22-26-30-38(29-25-13-10-2)71-57-52(77-56)42(61)41(60)34(5)67-57/h33-38,41-52,54-57,60-65H,9-32H2,1-8H3/t33-,34+,35-,36-,37-,38+,41-,42-,43-,44+,45+,46+,47-,48-,49-,50-,51-,52+,54-,55-,56-,57-/m0/s1 |
| InChIKey | HGWRMRQVIAZNKF-RFKWCNITSA-N |
| Mol Weight | 1105.4 g/mol |
| Molecular Formula | C57H100O20 |
| Exact Mass | 1104.680796 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2bRPzoqeED9 |
|---|---|
| Name | MURUCOIDIN-XIV |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C57H100O20 |
| InChI | InChI=1S/C57H100O20/c1-9-12-14-15-16-17-20-23-27-31-39(58)72-50-45(64)55(69-36(7)48(50)75-54-44(63)43(62)47(35(6)68-54)74-53(66)33(4)11-3)76-49-37(8)70-56-46(65)51(49)73-40(59)32-28-24-21-18-19-22-26-30-38(29-25-13-10-2)71-57-52(77-56)42(61)41(60)34(5)67-57/h33-38,41-52,54-57,60-65H,9-32H2,1-8H3/t33-,34+,35-,36-,37-,38+,41-,42-,43-,44+,45+,46+,47-,48-,49-,50-,51-,52+,54-,55-,56-,57-/m0/s1 |
| InChIKey | HGWRMRQVIAZNKF-RFKWCNITSA-N |
| Literature Reference Author | L.CHERIGO,R.PEREDA-MIRANDA,S.GIBBONS |
| Literature Reference Citation | PHYTOCHEM.,70,222(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.12.005 |
| Molecular Weight | 1105.409 g/mol |
| Sample ID | 63976 |
| Solvent | C5D5N |