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COUMABIOCIN_E
SpectraBase Compound ID 2kviqX1eJux
InChI InChI=1S/C31H36N2O12/c1-13(2)19(35)12-16-11-15(7-9-18(16)34)27(38)33-21-22(36)17-8-10-20(14(3)24(17)43-28(21)39)42-29-23(37)25(44-30(32)40)26(41-6)31(4,5)45-29/h7-11,19,23,25-26,29,34-37H,1,12H2,2-6H3,(H2,32,40)(H,33,38)/t19?,23-,25+,26-,29-/m0/s1
InChIKey NXIHCVXNQGOJKR-WKPJRIPMSA-N
Mol Weight 628.6 g/mol
Molecular Formula C31H36N2O12
Exact Mass 628.226825 g/mol
Enantiomer InChIKey NXIHCVXNQGOJKR-ORVJENOTSA-N
Unknown Identification

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