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SYMPLOSTATIN-3;MAJOR-CONFORMER
SpectraBase Compound ID CqFDxJKpp9w
InChI InChI=1S/C40H66N4O9/c1-13-26(6)35(43(10)38(47)33(24(2)3)41-37(46)34(25(4)5)42(8)9)30(51-11)23-32(45)44-21-17-20-29(44)36(52-12)27(7)40(50)53-31(39(48)49)22-28-18-15-14-16-19-28/h14-16,18-19,24-27,29-31,33-36H,13,17,20-23H2,1-12H3,(H,41,46)(H,48,49)/t26-,27+,29-,30+,31+,33-,34-,35-,36+/m1/s1
InChIKey PFMWLSLCVYOPSJ-CIMAXFCCSA-N
Mol Weight 747.0 g/mol
Molecular Formula C40H66N4O9
Exact Mass 746.48298 g/mol
Enantiomer InChIKey PFMWLSLCVYOPSJ-UJFJUDRFSA-N
Unknown Identification

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