RESIDUE 52I 69 CONECT C10 3 C07 O11 C13 CONECT C12 4 O11 H1 H2 H3 CONECT N01 3 C02 H4 H5 CONECT C02 3 N01 C03 N36 CONECT C03 3 C02 C04 C32 CONECT C04 4 C03 C05 H6 H7 CONECT C05 3 C04 C06 C31 CONECT C06 3 C05 C07 H8 CONECT C07 3 C10 C06 O08 CONECT O08 2 C07 C09 CONECT C09 4 O08 H9 H10 H11 CONECT O11 2 C10 C12 CONECT C13 3 C10 C31 C14 CONECT C31 3 C05 C13 H12 CONECT C32 3 C03 N33 H13 CONECT N33 2 C32 C34 CONECT C34 3 N33 N35 N36 CONECT N35 3 C34 H14 H15 CONECT N36 2 C02 C34 CONECT C14 3 C13 C15 H16 CONECT O30 1 C16 CONECT C16 3 O30 N17 C15 CONECT N17 3 C16 N18 C20 CONECT N18 2 N17 C19 CONECT C19 3 N18 C25 H19 CONECT C25 3 C19 C26 C24 CONECT C26 3 C25 C27 H20 CONECT C27 3 C26 C28 H21 CONECT C28 3 C27 C29 H22 CONECT C29 3 C28 C24 H23 CONECT C24 3 C25 C29 C20 CONECT C20 4 N17 C24 C21 H24 CONECT C21 4 C20 C22 H25 H26 CONECT C15 3 C14 C16 H27 CONECT C22 4 C21 C23 C37 H28 CONECT C23 4 C22 H29 H30 H31 CONECT C37 4 C22 H32 H33 H34 CONECT H1 1 C12 CONECT H2 1 C12 CONECT H3 1 C12 CONECT H4 1 N01 CONECT H5 1 N01 CONECT H6 1 C04 CONECT H7 1 C04 CONECT H8 1 C06 CONECT H9 1 C09 CONECT H10 1 C09 CONECT H11 1 C09 CONECT H12 1 C31 CONECT H13 1 C32 CONECT H14 1 N35 CONECT H15 1 N35 CONECT H16 1 C14 CONECT H19 1 C19 CONECT H20 1 C26 CONECT H21 1 C27 CONECT H22 1 C28 CONECT H23 1 C29 CONECT H24 1 C20 CONECT H25 1 C21 CONECT H26 1 C21 CONECT H27 1 C15 CONECT H28 1 C22 CONECT H29 1 C23 CONECT H30 1 C23 CONECT H31 1 C23 CONECT H32 1 C37 CONECT H33 1 C37 CONECT H34 1 C37 END HET 52I 69 HETSYN 52I (R,E)-3-(5-((2,4-diaminopyrimidin-5-yl)methyl)-2,3-dime HETSYN 2 52I thoxyphenyl)-1-(1-isobutylphthalazin-2(1H)-yl)prop-2-en HETSYN 3 52I -1-one HETNAM 52I (2E)-3-{5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimet HETNAM 2 52I hoxyphenyl}-1-[(1R)-1-(2-methylpropyl)phthalazin-2(1H)- HETNAM 3 52I yl]prop-2 -en-1-one FORMUL 52I C28 H32 N6 O3