RESIDUE B9N 54 CONECT O32 1 S13 CONECT S13 4 O32 O31 C14 C3 CONECT O31 1 S13 CONECT C14 3 S13 C19 C15 CONECT C19 3 C14 C20 C18 CONECT C20 4 C19 C25 C21 H1 CONECT C25 3 C20 O27 O26 CONECT O27 2 C25 H2 CONECT O26 1 C25 CONECT C21 4 C20 C22 H3 H4 CONECT C22 4 C21 C23 H5 H6 CONECT C23 3 C22 O30 O29 CONECT O30 1 C23 CONECT O29 2 C23 H7 CONECT C18 3 C19 C17 H8 CONECT C17 3 C18 C16 H9 CONECT C16 3 C17 C15 H10 CONECT C15 3 C14 C16 H11 CONECT C3 3 S13 C2 C4 CONECT C2 3 C3 C1 H12 CONECT C4 3 C3 C5 H13 CONECT C5 3 C4 C6 H14 CONECT C6 3 C5 C1 C7 CONECT C1 3 C2 C6 H15 CONECT C7 3 C6 C12 C8 CONECT C12 3 C7 C11 H16 CONECT C11 3 C12 C10 H17 CONECT C10 3 C11 O28 C9 CONECT O28 2 C10 C29 CONECT C29 4 O28 H18 H19 H20 CONECT C9 3 C10 C8 H21 CONECT C8 3 C7 C9 H22 CONECT H1 1 C20 CONECT H2 1 O27 CONECT H3 1 C21 CONECT H4 1 C21 CONECT H5 1 C22 CONECT H6 1 C22 CONECT H7 1 O29 CONECT H8 1 C18 CONECT H9 1 C17 CONECT H10 1 C16 CONECT H11 1 C15 CONECT H12 1 C2 CONECT H13 1 C4 CONECT H14 1 C5 CONECT H15 1 C1 CONECT H16 1 C12 CONECT H17 1 C11 CONECT H18 1 C29 CONECT H19 1 C29 CONECT H20 1 C29 CONECT H21 1 C9 CONECT H22 1 C8 END HET B9N 54 HETNAM B9N (2~{S})-2-[2-[4-(4-methoxyphenyl)phenyl]sulfonylphenyl] HETNAM 2 B9N pentanedioic acid FORMUL B9N C24 H22 O7 S1