KEGG:C11595 E3040 glucuronide ISISHOST03240423282D 1 1.00000 0.00000 12396 33 36 0 1 0 999 V2000 14.7963 -13.3005 0.0000 C 0 0 2 0 0 0 0 0 0 14.0957 -12.8961 0.0000 O 0 0 0 0 0 0 0 0 0 14.7968 -14.1095 0.0000 C 0 0 1 0 0 0 0 0 0 13.3967 -13.3031 0.0000 C 0 0 1 0 0 0 0 0 0 14.0966 -14.5140 0.0000 C 0 0 2 0 0 0 0 0 0 15.4992 -14.5067 0.0000 O 0 0 0 0 0 0 0 0 0 13.4002 -14.1138 0.0000 C 0 0 2 0 0 0 0 0 0 12.6960 -12.8987 0.0000 C 0 0 0 0 0 0 0 0 0 14.0989 -15.3241 0.0000 O 0 0 0 0 0 0 0 0 0 12.6970 -14.5166 0.0000 O 0 0 0 0 0 0 0 0 0 12.6955 -12.0898 0.0000 O 0 0 0 0 0 0 0 0 0 11.9958 -13.3074 0.0000 O 0 0 0 0 0 0 0 0 0 15.8149 -12.7662 0.0000 O 0 0 0 0 0 0 0 0 0 16.8125 -14.1499 0.0000 C 0 0 0 0 0 0 0 0 0 16.8125 -13.3458 0.0000 C 0 0 0 0 0 0 0 0 0 17.5120 -12.9416 0.0000 C 0 0 0 0 0 0 0 0 0 17.5120 -14.5499 0.0000 C 0 0 0 0 0 0 0 0 0 18.2073 -14.1499 0.0000 C 0 0 0 0 0 0 0 0 0 18.2039 -13.3438 0.0000 C 0 0 0 0 0 0 0 0 0 18.9686 -13.0890 0.0000 S 0 0 0 0 0 0 0 0 0 19.4448 -13.7395 0.0000 C 0 0 0 0 0 0 0 0 0 18.9741 -14.3939 0.0000 N 0 0 0 0 0 0 0 0 0 20.2490 -13.7361 0.0000 N 0 0 0 0 0 0 0 0 0 20.6502 -13.0365 0.0000 C 0 0 0 0 0 0 0 0 0 17.5130 -12.1374 0.0000 C 0 0 0 0 0 0 0 0 0 16.1149 -14.5503 0.0000 C 0 0 0 0 0 0 0 0 0 17.5131 -15.3541 0.0000 C 0 0 0 0 0 0 0 0 0 18.2114 -15.7574 0.0000 C 0 0 0 0 0 0 0 0 0 18.2091 -16.5580 0.0000 C 0 0 0 0 0 0 0 0 0 18.9032 -16.9613 0.0000 N 0 0 0 0 0 0 0 0 0 19.6005 -16.5562 0.0000 C 0 0 0 0 0 0 0 0 0 19.5995 -15.7520 0.0000 C 0 0 0 0 0 0 0 0 0 18.9011 -15.3488 0.0000 C 0 0 0 0 0 0 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 3 6 1 6 0 0 4 7 1 0 0 0 4 8 1 1 0 0 14 15 1 0 0 0 15 16 2 0 0 0 16 19 1 0 0 0 18 17 1 0 0 0 18 19 2 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 22 18 1 0 0 0 17 14 2 0 0 0 21 23 1 0 0 0 23 24 1 0 0 0 5 9 1 1 0 0 16 25 1 0 0 0 15 13 1 0 0 0 7 10 1 6 0 0 14 26 1 0 0 0 1 13 1 1 0 0 17 27 1 0 0 0 27 28 1 0 0 0 8 11 1 0 0 0 8 12 2 0 0 0 5 7 1 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 28 29 2 0 0 0 29 30 1 0 0 0 30 31 2 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 33 28 1 0 0 0 M END