SpectraBase Compound ID | 1XVMtv7ufxt |
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InChI | InChI=1S/C62H100O24/c1-29(2)30(3)21-45(65)82-44-27-43-58(9)17-16-37(22-36(58)15-18-61(43,70)62(71)20-19-60(69,35(8)64)59(44,62)10)80-46-23-38(72-11)53(31(4)76-46)83-47-24-39(73-12)54(32(5)77-47)84-48-25-40(74-13)55(33(6)78-48)85-49-26-41(75-14)56(34(7)79-49)86-57-52(68)51(67)50(66)42(28-63)81-57/h15,21,29,31-34,37-44,46-57,63,66-71H,16-20,22-28H2,1-14H3/b30-21+/t31-,32+,33-,34+,37+,38+,39-,40-,41+,42-,43-,44-,46+,47-,48+,49-,50-,51+,52-,53-,54+,55-,56+,57+,58+,59-,60-,61+,62-/m1/s1 |
InChIKey | SVKCWFDZGPCWRM-XTLNISSISA-N |
Mol Weight | 1229.5 g/mol |
Molecular Formula | C62H100O24 |
Exact Mass | 1228.660454 g/mol |
SpectraBase Spectrum ID | 9SBlwyKDDGI |
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Name | CAUDATIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-OLEANDROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA |
Compound Number | 4 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C62H100O24 |
InChI | InChI=1S/C62H100O24/c1-29(2)30(3)21-45(65)82-44-27-43-58(9)17-16-37(22-36(58)15-18-61(43,70)62(71)20-19-60(69,35(8)64)59(44,62)10)80-46-23-38(72-11)53(31(4)76-46)83-47-24-39(73-12)54(32(5)77-47)84-48-25-40(74-13)55(33(6)78-48)85-49-26-41(75-14)56(34(7)79-49)86-57-52(68)51(67)50(66)42(28-63)81-57/h15,21,29,31-34,37-44,46-57,63,66-71H,16-20,22-28H2,1-14H3/b30-21+/t31-,32+,33-,34+,37+,38+,39-,40-,41+,42-,43-,44-,46+,47-,48+,49-,50-,51+,52-,53-,54+,55-,56+,57+,58+,59-,60-,61+,62-/m1/s1 |
InChIKey | SVKCWFDZGPCWRM-XTLNISSISA-N |
Literature Reference Author | T.WARASHINA,T.NORO |
Literature Reference Citation | PHYTOCHEM.,44,917(1997) |
Literature Reference DOI | 10.1016/S0031-9422(96)00640-1 |
Molecular Weight | 1229.462 g/mol |
Solvent | C5D5N |
Source File Reference | UWPA331 |