KEGG:C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate ISISHOST01040522332D 1 1.00000 0.00000 12591 33 36 0 1 0 999 V2000 1.9084 -13.0833 0.0000 C 0 0 0 0 0 0 0 0 0 1.9084 -13.8916 0.0000 C 0 0 2 0 0 0 0 0 0 2.6121 -14.2958 0.0000 C 0 0 0 0 0 0 0 0 0 2.6121 -12.6750 0.0000 C 0 0 0 0 0 0 0 0 0 3.3116 -13.0833 0.0000 C 0 0 1 0 0 0 0 0 0 3.3080 -13.8916 0.0000 C 0 0 2 0 0 0 0 0 0 4.0041 -14.2988 0.0000 C 0 0 0 0 0 0 0 0 0 4.7078 -13.8977 0.0000 C 0 0 0 0 0 0 0 0 0 4.0111 -12.6780 0.0000 C 0 0 2 0 0 0 0 0 0 4.7078 -13.0911 0.0000 C 0 0 2 0 0 0 0 0 0 4.7213 -11.4746 0.0000 C 0 0 1 0 0 0 0 0 0 4.0179 -11.8719 0.0000 C 0 0 0 0 0 0 0 0 0 5.4139 -11.8835 0.0000 C 0 0 1 0 0 0 0 0 0 5.4040 -12.6872 0.0000 C 0 0 1 0 0 0 0 0 0 6.7998 -12.7044 0.0000 C 0 0 0 0 0 0 0 0 0 6.8098 -11.9008 0.0000 C 0 0 0 0 0 0 0 0 0 6.1168 -11.4903 0.0000 C 0 0 2 0 0 0 0 0 0 6.1268 -10.6820 0.0000 C 0 0 1 0 0 0 0 0 0 6.8250 -10.2875 0.0000 C 0 0 0 0 0 0 0 0 0 7.5209 -10.7000 0.0000 C 0 0 0 0 0 0 0 0 0 8.2250 -10.3083 0.0000 C 0 0 0 0 0 0 0 0 0 8.9167 -10.7208 0.0000 O 0 0 0 0 0 0 0 0 0 8.2362 -9.5000 0.0000 O 0 0 0 0 0 0 0 0 0 5.4295 -10.2699 0.0000 C 0 0 0 0 0 0 0 0 0 5.4084 -11.0750 0.0000 C 0 0 0 0 0 0 0 0 0 4.7167 -10.6625 0.0000 O 0 0 0 0 0 0 0 0 0 1.2084 -14.2916 0.0000 O 0 0 0 0 0 0 0 0 0 3.3000 -14.6958 0.0000 H 0 0 0 0 0 0 0 0 0 3.3042 -12.2708 0.0000 C 0 0 0 0 0 0 0 0 0 6.8292 -11.0708 0.0000 H 0 0 0 0 0 0 0 0 0 5.3958 -13.5083 0.0000 H 0 0 0 0 0 0 0 0 0 4.0042 -13.5000 0.0000 H 0 0 0 0 0 0 0 0 0 4.7417 -12.2625 0.0000 H 0 0 0 0 0 0 0 0 0 7 8 2 0 0 0 13 14 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 17 13 1 0 0 0 14 15 1 0 0 0 8 10 1 0 0 0 17 18 1 0 0 0 9 5 1 0 0 0 18 19 1 0 0 0 5 4 1 0 0 0 19 20 1 0 0 0 4 1 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 1 2 1 0 0 0 21 23 2 0 0 0 9 10 1 0 0 0 18 24 1 6 0 0 10 14 1 0 0 0 13 25 1 1 0 0 13 11 1 0 0 0 11 26 1 6 0 0 11 12 1 0 0 0 2 27 1 6 0 0 12 9 1 0 0 0 6 28 1 1 0 0 2 3 1 0 0 0 5 29 1 1 0 0 17 30 1 6 0 0 3 6 1 0 0 0 14 31 1 6 0 0 5 6 1 0 0 0 9 32 1 6 0 0 6 7 1 0 0 0 10 33 1 1 0 0 M END