| SpectraBase Compound ID | A6xlNHQ3QgV |
|---|---|
| InChI | InChI=1S/C48H80O17/c1-21-30(50)33(53)35(55)39(58-21)62-37-32(52)25(20-49)60-41(38(37)63-40-36(56)34(54)31(51)22(2)59-40)61-28-13-14-44(7)26(42(28,3)4)12-16-45(8)27(44)19-24-29-23(11-15-46(29,45)9)47(10)17-18-48(64-24,65-47)43(5,6)57/h21-41,49-57H,11-20H2,1-10H3/t21-,22+,23+,24-,25+,26+,27-,28+,29+,30-,31+,32+,33+,34-,35+,36-,37-,38+,39-,40+,41-,44+,45-,46-,47+,48+/m1/s1 |
| InChIKey | IEJPZQXSDZIUBZ-WDAVMWGSSA-N |
| Mol Weight | 929.2 g/mol |
| Molecular Formula | C48H80O17 |
| Exact Mass | 928.539551 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | RPwnRaGsYW |
|---|---|
| Name | NEOALSOSIDE_O2 |
| Compound Number | 24 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H80O17 |
| InChI | InChI=1S/C48H80O17/c1-21-30(50)33(53)35(55)39(58-21)62-37-32(52)25(20-49)60-41(38(37)63-40-36(56)34(54)31(51)22(2)59-40)61-28-13-14-44(7)26(42(28,3)4)12-16-45(8)27(44)19-24-29-23(11-15-46(29,45)9)47(10)17-18-48(64-24,65-47)43(5,6)57/h21-41,49-57H,11-20H2,1-10H3/t21-,22+,23+,24-,25+,26+,27-,28+,29+,30-,31+,32+,33+,34-,35+,36-,37-,38+,39-,40+,41-,44+,45-,46-,47+,48+/m1/s1 |
| InChIKey | IEJPZQXSDZIUBZ-WDAVMWGSSA-N |
| Literature Reference Author | S.FUJITA,R.KASAI,K.OHTANI,K.YAMASAKI,C.M.HUA,N.RUI-LIN,O.TAN AKA |
| Literature Reference Citation | PHYTOCHEM.,39,591(1995) |
| Literature Reference DOI | 10.1016/0031-9422(95)00020-8 |
| Molecular Weight | 929.153 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8540 |