| SpectraBase Compound ID | K6TkiORsfs4 |
|---|---|
| InChI | InChI=1S/C86H142O40/c1-37-52(95)57(100)63(106)74(116-37)112-28-18-14-10-11-15-19-40(89)20-16-12-13-17-21-43(90)72(110)121-68-39(3)118-79(70(69(68)123-77-64(107)58(101)55(98)47(32-87)119-77)124-76-66(109)60(103)67(38(2)117-76)122-75-62(105)54(97)46(93)34-114-75)126-80(111)86-27-26-81(4,5)29-42(86)41-22-23-50-82(6)30-44(91)71(83(7,36-88)49(82)24-25-84(50,8)85(41,9)31-51(86)94)125-78-65(108)59(102)56(99)48(120-78)35-115-73-61(104)53(96)45(92)33-113-73/h22,37-39,42-71,73-79,87-88,90-109H,10-21,23-36H2,1-9H3/t37-,38+,39-,42+,43?,44+,45+,46+,47+,48-,49-,50-,51-,52-,53+,54-,55+,56-,57+,58-,59+,60+,61-,62+,63+,64+,65-,66-,67+,68+,69+,70-,71+,73+,74+,75-,76+,77-,78+,79+,82+,83+,84-,85-,86-/m1/s1 |
| InChIKey | KWUFIZHARBMCSW-RCCRPTSISA-N |
| Mol Weight | 1816.0 g/mol |
| Molecular Formula | C86H142O40 |
| Exact Mass | 1814.907739 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LR5hyGbffZ |
|---|---|
| Name | KWUFIZHARBMCSW-RCCRPTSISA-N |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C86H142O40 |
| InChI | InChI=1S/C86H142O40/c1-37-52(95)57(100)63(106)74(116-37)112-28-18-14-10-11-15-19-40(89)20-16-12-13-17-21-43(90)72(110)121-68-39(3)118-79(70(69(68)123-77-64(107)58(101)55(98)47(32-87)119-77)124-76-66(109)60(103)67(38(2)117-76)122-75-62(105)54(97)46(93)34-114-75)126-80(111)86-27-26-81(4,5)29-42(86)41-22-23-50-82(6)30-44(91)71(83(7,36-88)49(82)24-25-84(50,8)85(41,9)31-51(86)94)125-78-65(108)59(102)56(99)48(120-78)35-115-73-61(104)53(96)45(92)33-113-73/h22,37-39,42-71,73-79,87-88,90-109H,10-21,23-36H2,1-9H3/t37-,38+,39-,42+,43?,44+,45+,46+,47+,48-,49-,50-,51-,52-,53+,54-,55+,56-,57+,58-,59+,60+,61-,62+,63+,64+,65-,66-,67+,68+,69+,70-,71+,73+,74+,75-,76+,77-,78+,79+,82+,83+,84-,85-,86-/m1/s1 |
| InChIKey | KWUFIZHARBMCSW-RCCRPTSISA-N |
| Literature Reference Author | Y.ASADA,M.IKENO,T.FURUYA |
| Literature Reference Citation | PHYTOCHEM.,35,757(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90600-9 |
| Molecular Weight | 1816.049 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWLU25128 |