KEGG:C06495 Compound III(S) ISISHOST03240423142D 1 1.00000 0.00000 5564 27 29 0 0 0 999 V2000 2.9517 0.6448 0.0000 C 0 0 0 0 0 0 0 0 0 3.6621 1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 2.9517 -0.1793 0.0000 C 0 0 0 0 0 0 0 0 0 2.2414 1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 4.4138 0.7241 0.0000 N 0 0 0 0 0 0 0 0 0 3.7483 1.8724 0.0000 O 0 0 0 0 0 0 0 0 0 2.2414 -0.5931 0.0000 C 0 0 0 0 0 0 0 0 0 1.5310 0.6448 0.0000 C 0 0 0 0 0 0 0 0 0 4.9655 1.3345 0.0000 C 0 0 3 0 0 0 0 0 0 4.5517 2.0483 0.0000 C 0 0 0 0 0 0 0 0 0 1.5345 -0.1793 0.0000 C 0 0 0 0 0 0 0 0 0 5.7793 1.2483 0.0000 C 0 0 0 0 0 0 0 0 0 0.8276 -0.5897 0.0000 O 0 0 0 0 0 0 0 0 0 6.1138 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0.1172 -0.1828 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5897 -0.5931 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3000 -0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0138 -0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7241 -0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 -3.4379 -0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 -4.1483 -0.1862 0.0000 C 0 0 0 0 0 0 0 0 0 -4.8586 -0.6000 0.0000 C 0 0 0 0 0 0 0 0 0 -4.9448 -1.4103 0.0000 C 0 0 0 0 0 0 0 0 0 -5.6103 -0.2586 0.0000 O 0 0 0 0 0 0 0 0 0 -5.7483 -1.5828 0.0000 C 0 0 0 0 0 0 0 0 0 -6.1621 -0.8690 0.0000 N 0 0 0 0 0 0 0 0 0 -6.0862 -2.3345 0.0000 C 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 2 5 2 0 0 0 2 6 1 0 0 0 3 7 2 0 0 0 4 8 1 0 0 0 5 9 1 0 0 0 6 10 1 0 0 0 7 11 1 0 0 0 9 12 1 0 0 0 11 13 1 0 0 0 12 14 1 0 0 0 13 15 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 22 24 1 0 0 0 23 25 1 0 0 0 24 26 1 0 0 0 25 27 1 0 0 0 8 11 2 0 0 0 9 10 1 0 0 0 25 26 2 0 0 0 M END