RESIDUE 3KL 65 CONECT C2 4 C3 C1 H1 H2 CONECT C3 3 C2 O3 C4 CONECT O3 1 C3 CONECT C4 4 C3 C5 H3 H4 CONECT C5 4 C4 C6 C10 H5 CONECT C6 4 C5 C7 H6 H7 CONECT C1 4 C2 C10 H8 H9 CONECT C7 4 C6 C8 H10 H11 CONECT C8 4 C7 C9 C14 H12 CONECT C9 4 C8 C10 C11 H13 CONECT C10 4 C5 C1 C9 C19 CONECT C11 4 C9 C12 H14 H15 CONECT C12 4 C11 C13 H16 H17 CONECT C13 4 C12 C14 C17 C18 CONECT C14 4 C8 C13 C15 H18 CONECT C15 4 C14 C16 H19 H20 CONECT C16 4 C15 C17 H21 H22 CONECT C17 4 C13 C16 C20 H23 CONECT C18 4 C13 H24 H25 H26 CONECT C19 4 C10 H27 H28 H29 CONECT C20 4 C17 C21 C22 H30 CONECT C21 4 C20 H31 H32 H33 CONECT C22 4 C20 C23 H34 H35 CONECT C23 4 C22 C24 H36 H37 CONECT C24 3 C23 OT1 OT2 CONECT OT1 2 C24 H38 CONECT OT2 1 C24 CONECT H1 1 C2 CONECT H2 1 C2 CONECT H3 1 C4 CONECT H4 1 C4 CONECT H5 1 C5 CONECT H6 1 C6 CONECT H7 1 C6 CONECT H8 1 C1 CONECT H9 1 C1 CONECT H10 1 C7 CONECT H11 1 C7 CONECT H12 1 C8 CONECT H13 1 C9 CONECT H14 1 C11 CONECT H15 1 C11 CONECT H16 1 C12 CONECT H17 1 C12 CONECT H18 1 C14 CONECT H19 1 C15 CONECT H20 1 C15 CONECT H21 1 C16 CONECT H22 1 C16 CONECT H23 1 C17 CONECT H24 1 C18 CONECT H25 1 C18 CONECT H26 1 C18 CONECT H27 1 C19 CONECT H28 1 C19 CONECT H29 1 C19 CONECT H30 1 C20 CONECT H31 1 C21 CONECT H32 1 C21 CONECT H33 1 C21 CONECT H34 1 C22 CONECT H35 1 C22 CONECT H36 1 C23 CONECT H37 1 C23 CONECT H38 1 OT1 END HET 3KL 65 HETSYN 3KL 3-keto-lithocholic acid HETNAM 3KL (5beta,9beta)-3-oxocholan-24-oic acid FORMUL 3KL C24 H38 O3