| SpectraBase Compound ID | ENhr3quRsn3 |
|---|---|
| InChI | InChI=1S/C48H84O19/c1-21-31(53)34(56)36(58)40(62-21)66-38-33(55)25(19-49)64-42(39(38)67-41-37(59)35(57)32(54)22(2)63-41)65-29-13-14-44(5)26(45(29,6)20-50)11-16-46(7)27(44)18-24(51)30-23(10-15-47(30,46)8)48(9,61)17-12-28(52)43(3,4)60/h21-42,49-61H,10-20H2,1-9H3/t21-,22+,23+,24-,25+,26-,27-,28-,29+,30+,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | VWLYKPYQSHVNHX-RYQQSZTHSA-N |
| Mol Weight | 965.2 g/mol |
| Molecular Formula | C48H84O19 |
| Exact Mass | 964.56068 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EbIQlLwMB17 |
|---|---|
| Name | NEOALSOSIDE_J1 |
| Compound Number | 16 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H84O19 |
| InChI | InChI=1S/C48H84O19/c1-21-31(53)34(56)36(58)40(62-21)66-38-33(55)25(19-49)64-42(39(38)67-41-37(59)35(57)32(54)22(2)63-41)65-29-13-14-44(5)26(45(29,6)20-50)11-16-46(7)27(44)18-24(51)30-23(10-15-47(30,46)8)48(9,61)17-12-28(52)43(3,4)60/h21-42,49-61H,10-20H2,1-9H3/t21-,22+,23+,24-,25+,26-,27-,28-,29+,30+,31-,32+,33+,34+,35-,36+,37-,38-,39+,40-,41+,42-,44+,45+,46-,47-,48+/m1/s1 |
| InChIKey | VWLYKPYQSHVNHX-RYQQSZTHSA-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 | 965.184 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ8530 |