| SpectraBase Compound ID | BaYkr9r8YTG |
|---|---|
| InChI | InChI=1S/C56H38O12/c57-26-7-1-23(2-8-26)43-46-35(16-30(61)19-38(46)64)51-47-36(17-31(62)20-41(47)67-55(51)25-5-11-28(59)12-6-25)49(43)50-37-18-32(63)21-42-48(37)54-53-45(34-15-29(60)13-14-33(34)56(54)68-42)39(65)22-40(66)52(53)44(50)24-3-9-27(58)10-4-24/h1-22,43-44,49-51,55,57-66H/t43-,44-,49-,50+,51+,55-/m1/s1 |
| InChIKey | MHXQOSXHVFCPEQ-AYIPRNLQSA-N |
| Mol Weight | 902.9 g/mol |
| Molecular Formula | C56H38O12 |
| Exact Mass | 902.236327 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IDDLtFuRdK5 |
|---|---|
| Name | AMURENSIN-I |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H38O12 |
| InChI | InChI=1S/C56H38O12/c57-26-7-1-23(2-8-26)43-46-35(16-30(61)19-38(46)64)51-47-36(17-31(62)20-41(47)67-55(51)25-5-11-28(59)12-6-25)49(43)50-37-18-32(63)21-42-48(37)54-53-45(34-15-29(60)13-14-33(34)56(54)68-42)39(65)22-40(66)52(53)44(50)24-3-9-27(58)10-4-24/h1-22,43-44,49-51,55,57-66H/t43-,44-,49-,50+,51+,55-/m1/s1 |
| InChIKey | MHXQOSXHVFCPEQ-AYIPRNLQSA-N |
| Literature Reference Author | K.S.HUANG,M.LIN,G.F.CHENG |
| Literature Reference Citation | PHYTOCHEM.,58,357(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00224-2 |
| Molecular Weight | 902.911 g/mol |
| Solvent | ACETONE-D6 |
| Source File Reference | UWLU2819 |
| SpectraBase Batch ID | AkObWMDyyOQ |