PDB Code: ICL
X-PLOR files
Heterogen file generated from the PDB Het Group Dictionary
PICTURE ICL
C12 H1--C1(==O1)--C2
| / \
C17 C11--C10--C9--C8--N1---C7 C3-CL
\ | || | | O |
C16--C14 O3 | O2 HN1 C6 C4
/ \ || | \ /
C15 O4--C13-----N2--HN2 C5
END
RESIDUE ICL 47
CONECT C1 3 C2 O1 H1
CONECT O1 1 C1
CONECT C2 3 C1 C3 C7
CONECT C3 3 C2 C4 CL
CONECT CL 1 C3
CONECT C4 3 C3 C5 H4
CONECT C5 3 C4 C6 H5
CONECT C6 3 C5 C7 H6
CONECT C7 3 C2 C6 N1
CONECT N1 3 C7 C8 HN1
CONECT C8 3 N1 C9 O2
CONECT O2 1 C8
CONECT C9 4 C8 C10 N2 H9
CONECT C10 4 C9 C11 C12 H10
CONECT C11 4 C10 1H11 2H11 3H11
CONECT C12 4 C10 1H12 2H12 3H12
CONECT N2 3 C9 C13 HN2
CONECT C13 3 N2 O3 O4
CONECT O3 1 C13
CONECT O4 2 C13 C14
CONECT C14 4 O4 C15 C16 C17
CONECT C15 4 C14 1H15 2H15 3H15
CONECT C16 4 C14 1H16 2H16 3H16
CONECT C17 4 C14 1H17 2H17 3H17
CONECT H1 1 C1
CONECT H4 1 C4
CONECT H5 1 C5
CONECT H6 1 C6
CONECT HN1 1 N1
CONECT H9 1 C9
CONECT H10 1 C10
CONECT 1H11 1 C11
CONECT 2H11 1 C11
CONECT 3H11 1 C11
CONECT 1H12 1 C12
CONECT 2H12 1 C12
CONECT 3H12 1 C12
CONECT HN2 1 N2
CONECT 1H15 1 C15
CONECT 2H15 1 C15
CONECT 3H15 1 C15
CONECT 1H16 1 C16
CONECT 2H16 1 C16
CONECT 3H16 1 C16
CONECT 1H17 1 C17
CONECT 2H17 1 C17
CONECT 3H17 1 C17
END
HET ICL 47
HETNAM ICL 1-(5-CHLORO-4-OXO-4H-3,1,BENZOXAZINE-2-YL)-2-METHYL-
HETNAM 2 ICL PROPYL CARBONIC ACID-1,1-DIMETHYLETHYL-ETHER
FORMUL ICL C17 H23 N2 O4 CL1