SpectraBase Compound ID | 16WNdKj2WFK |
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InChI | InChI=1S/C48H78O22S/c1-20(2)29(51)23-15-46(8,70-71(59,60)61)39-22-9-10-27-44(6)13-12-28(43(4,5)26(44)11-14-45(27,7)47(22)18-48(39,69-23)62-19-47)66-42-38(68-41-35(57)33(55)31(53)24(16-49)64-41)36(58)37(25(17-50)65-42)67-40-34(56)32(54)30(52)21(3)63-40/h21-42,49-58H,1,9-19H2,2-8H3,(H,59,60,61)/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-/m0/s1 |
InChIKey | WESPIIDSVYCNKJ-VRHZLEQBSA-N |
Mol Weight | 1039.2 g/mol |
Molecular Formula | C48H78O22S |
Exact Mass | 1038.470545 g/mol |
SpectraBase Spectrum ID | BuxmYjsUVRh |
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Name | MABIOSIDE-E |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C48H78O22S |
InChI | InChI=1S/C48H78O22S/c1-20(2)29(51)23-15-46(8,70-71(59,60)61)39-22-9-10-27-44(6)13-12-28(43(4,5)26(44)11-14-45(27,7)47(22)18-48(39,69-23)62-19-47)66-42-38(68-41-35(57)33(55)31(53)24(16-49)64-41)36(58)37(25(17-50)65-42)67-40-34(56)32(54)30(52)21(3)63-40/h21-42,49-58H,1,9-19H2,2-8H3,(H,59,60,61)/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-/m0/s1 |
InChIKey | WESPIIDSVYCNKJ-VRHZLEQBSA-N |
Literature Reference Author | A.OULAD-ALI,D.GUILLAUME,B.WENIGER,Y.JIANG,R.ANTON |
Literature Reference Citation | PHYTOCHEM.,36,445(1994) |
Literature Reference DOI | 10.1016/S0031-9422(00)97092-4 |
Molecular Weight | 1039.194 g/mol |
Solvent | CD3OD |
Source File Reference | UWMS25236 |