SpectraBase Compound ID | CnIqhaPVXbp |
---|---|
InChI | InChI=1S/C25H42O9.C25H40O9/c2*1-7-25(6,13-9-12-16(2)10-8-11-17(3)14-26)34-24-23(32-19(5)28)22(30)21(29)20(33-24)15-31-18(4)27/h7,12,17,20-24,26,29-30H,1,8-11,13-15H2,2-6H3;7,11-12,20-24,26,29-30H,1,8-10,13-15H2,2-6H3/b16-12+;16-12+,17-11+/t17?,20-,21-,22+,23-,24+,25+;20-,21-,22+,23-,24+,25+/m00/s1 |
InChIKey | QTIHCNYKWGGCJC-CLGRUNHOSA-N |
Mol Weight | 971.2 g/mol |
Molecular Formula | C50H82O18 |
Exact Mass | 970.550116 g/mol |
Enantiomer InChIKey | QTIHCNYKWGGCJC-GIACVHNPSA-N |
Title | Journal or Book | Year |
---|---|---|
Isoflavones, a sesquiterpene lactone-monoterpene adduct and other constituents of Gaillardia species | Phytochemistry | 1991 |
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