SpectraBase Compound ID | 63ibLUUYeR0 |
---|---|
InChI | InChI=1S/C42H58O22/c1-5-21-23(25(36(52)53)17-59-39(21)63-41-34(50)32(48)30(46)27(15-43)61-41)10-12-57-29(45)14-19(3)8-7-9-20(4)38(56)58-13-11-24-22(6-2)40(60-18-26(24)37(54)55)64-42-35(51)33(49)31(47)28(16-44)62-42/h5-6,9,14,17-18,21-24,27-28,30-35,39-44,46-51H,1-2,7-8,10-13,15-16H2,3-4H3,(H,52,53)(H,54,55)/b19-14+,20-9+/t21?,22?,23?,24?,27-,28-,30-,31-,32+,33+,34-,35-,39?,40?,41+,42-/m1/s1 |
InChIKey | NFTKPZDGVJFCAB-MMPZXNEBSA-N |
Mol Weight | 914.9 g/mol |
Molecular Formula | C42H58O22 |
Exact Mass | 914.341973 g/mol |
Enantiomer InChIKey | NFTKPZDGVJFCAB-UYDMJWKKSA-N |
Title | Journal or Book | Year |
---|---|---|
Rhodenthoside A, a New Type of Acylated Secoiridoid Glycoside fromGentiana rhodentha | Helvetica Chimica Acta | 1994 |
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