| SpectraBase Compound ID | 1n9PvhXYZlQ |
|---|---|
| InChI | InChI=1S/C56H66O30/c1-26-46(78-33(8)63)48(79-34(9)64)51(80-35(10)65)54(73-26)84-49-47(83-45(68)18-15-38-13-16-40(74-29(4)59)42(21-38)76-31(6)61)44(23-70-27(2)57)82-53(69-20-19-39-14-17-41(75-30(5)60)43(22-39)77-32(7)62)50(49)85-55-52(81-36(11)66)56(25-72-55,86-37(12)67)24-71-28(3)58/h13-18,21-22,26,44,46-55H,19-20,23-25H2,1-12H3/b18-15+/t26-,44+,46-,47+,48+,49-,50+,51+,52-,53+,54-,55+,56-/m0/s1 |
| InChIKey | AUFZGTQUAILSQW-BJDODMNDSA-N |
| Mol Weight | 1219.1 g/mol |
| Molecular Formula | C56H66O30 |
| Exact Mass | 1218.363891 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3E5rscRvL1K |
|---|---|
| Name | LUTEOSIDE_A-UNDECAACETATE |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C56H66O30 |
| InChI | InChI=1S/C56H66O30/c1-26-46(78-33(8)63)48(79-34(9)64)51(80-35(10)65)54(73-26)84-49-47(83-45(68)18-15-38-13-16-40(74-29(4)59)42(21-38)76-31(6)61)44(23-70-27(2)57)82-53(69-20-19-39-14-17-41(75-30(5)60)43(22-39)77-32(7)62)50(49)85-55-52(81-36(11)66)56(25-72-55,86-37(12)67)24-71-28(3)58/h13-18,21-22,26,44,46-55H,19-20,23-25H2,1-12H3/b18-15+/t26-,44+,46-,47+,48+,49-,50+,51+,52-,53+,54-,55+,56-/m0/s1 |
| InChIKey | AUFZGTQUAILSQW-BJDODMNDSA-N |
| Literature Reference Author | M.R.KERNAN,A.AMARQUAYE,J.L.CHEN,J.CHAN,D.F.SESIN,N.PARKINSON ,Z.J.YE,M.BARRETT,C. |
| Literature Reference Citation | J.NAT.PROD.,61,564(1998) |
| Literature Reference DOI | 10.1021/np9703914 |
| Molecular Weight | 1219.122 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ589 |