UNC6852

Chemický názov:

(2S,4R)-1-((S)-2-(4-(4-(5-((furán-2-ylmetyl)amino)-[1,2,4]triazolo[4,3-c] pyrimidín-8-yl)benzamido)butánamido)-3,3-dimetylbutanoyl)-4-hydroxy-N-(4-(4-metyltiazol-5-yl)benzyl)pyrolidín-2-karboxamid

SMILES kód:

O=C([C@H]1N(C([C@@H](NC(CCCNC(C2=CC=C(C3=CN=C(NCC4=CC=CO4)N5C3=NN=C5)C= C2)=0)=0)C(C)(C)C)=0)C[CH](0)C1)NCC6=CC=C(C7=C(C)N=CS7)C=C6

InChi kód:

InChI=1S/C43H48N10O6S/c1-26-36(60-25-48-26)29-11-9-27(10-12-29)20-45-40(57)34-19-31(54) 23-52(34)41(58)37(43(2,3)4)50-35(55)8-5-17-44-39(56)30-15-13-28(14-16- 30)33-22-47-42(53-24-49-51-38(33)53)46-21-32-7-6-18-59-32/h6-7,9-16,18, 22,24-25,31,34,37,54H,5,8,17,19-21,23H2,1-4H3,(H,44,56)(H,45,57)(H,46,47) )(H,50,55)/t31-,34+,37-/m1/s1

Kľúč InChi:

PPNNFXIBKLCMTI-WXEAQWFJSA-N

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