| SpectraBase Compound ID | 1E3gLCIoGLC |
|---|---|
| InChI | InChI=1S/C48H76O19/c1-21-29(51)31(53)34(56)39(63-21)66-37-24(19-49)64-38(36(58)33(37)55)62-20-25-30(52)32(54)35(57)40(65-25)67-42(61)48-16-14-44(4,41(59)60)18-23(48)22-8-9-27-45(5)12-11-28(50)43(2,3)26(45)10-13-47(27,7)46(22,6)15-17-48/h8,21,23-40,49-58H,9-20H2,1-7H3,(H,59,60)/t21-,23+,24-,25-,26+,27-,28-,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39-,40+,44-,45+,46-,47-,48+/m1/s1 |
| InChIKey | JJXSXIOEXNGBTI-OMFAPGMDSA-N |
| Mol Weight | 957.1 g/mol |
| Molecular Formula | C48H76O19 |
| Exact Mass | 956.49808 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ISxPawGDFN |
|---|---|
| Name | JJXSXIOEXNGBTI-OMFAPGMDSA-N |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H76O19 |
| InChI | InChI=1S/C48H76O19/c1-21-29(51)31(53)34(56)39(63-21)66-37-24(19-49)64-38(36(58)33(37)55)62-20-25-30(52)32(54)35(57)40(65-25)67-42(61)48-16-14-44(4,41(59)60)18-23(48)22-8-9-27-45(5)12-11-28(50)43(2,3)26(45)10-13-47(27,7)46(22,6)15-17-48/h8,21,23-40,49-58H,9-20H2,1-7H3,(H,59,60)/t21-,23+,24-,25-,26+,27-,28-,29-,30-,31+,32+,33-,34+,35-,36-,37-,38-,39-,40+,44-,45+,46-,47-,48+/m1/s1 |
| InChIKey | JJXSXIOEXNGBTI-OMFAPGMDSA-N |
| Literature Reference Author | M.MIYAKOSHI,Y.IDA,S.ISODA,J.SHOJI |
| Literature Reference Citation | PHYTOCHEM.,34,1599(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90853-7 |
| Molecular Weight | 957.120 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU20786 |