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Temsirolimus Impurity 2

SZ CAT No SZ-T011003
CAS No 1027067-40-8
Mol.F. C56H87NO16
Mol.Wt. 1030.3
Inv. Status Under Synthesis


Smiles: O=C(C(O[C@](CC1)([H])C[C@](/C(C)=C\C=C\C=C\[C@H](C[C@H]2C)C)([H])OC)(C([C@@H]1C)=O)O)N(CCCC3)[C@]3([H])C(OC(CC([C@@H](/C=C([C@H]([C@@](C2=O)([H])OC)O)\C)C)=O)[C@H](C)C[C@H](CC[C@H]4OC(C(CO)(C)CO)=O)C[C@H]4OC)=O

Inchi: InChI=1S/C55H85NO16/c1-32-16-12-11-13-17-33(2)42(59)28-40-21-19-38(7)55(67,72-40)50(63)51(64)56-23-15-14-18-41(56)52(65)70-45(29-43(60)34(3)25-37(6)48(62)49(69-10)47(61)36(5)24-32)35(4)26-39-20-22-44(46(27-39)68-9)71-53(66)54(8,30-57)31-58/h11-13,16-17,25,32,34-36,38-42,44-46,48-49,57-59,62,67H,14-15,18-24,26-31H2,1-10H3/b13-11+,16-12+,33-17+,37-25+/t32-,34-,35-,36-,38-,39+,40+,41+,42?,44-,45+,46-,48-,49+,55-/m1/s1