KEGG:C05460 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA ISISHOST03240423122D 1 1.00000 0.00000 4631 80 86 0 0 0 999 V2000 10.1237 -15.5130 0.0000 C 0 0 3 0 0 0 0 0 0 10.7818 -15.8932 0.0000 C 0 0 3 0 0 0 0 0 0 10.1314 -14.7452 0.0000 C 0 0 3 0 0 0 0 0 0 8.7889 -15.5165 0.0000 C 0 0 0 0 0 0 0 0 0 11.4474 -15.5241 0.0000 C 0 0 3 0 0 0 0 0 0 10.7783 -16.6578 0.0000 C 0 0 1 0 0 0 0 0 0 9.4615 -14.3684 0.0000 C 0 0 3 0 0 0 0 0 0 10.7928 -14.3684 0.0000 C 0 0 2 0 0 0 0 0 0 10.1168 -13.9592 0.0000 C 0 0 0 0 0 0 0 0 0 8.7966 -14.7452 0.0000 C 0 0 0 0 0 0 0 0 0 12.0978 -15.9078 0.0000 C 0 0 3 0 0 0 0 0 0 11.4509 -14.7561 0.0000 C 0 0 0 0 0 0 0 0 0 11.4288 -17.0414 0.0000 C 0 0 0 0 0 0 0 0 0 10.1168 -17.0268 0.0000 O 0 0 0 0 0 0 0 0 0 9.4691 -13.5970 0.0000 C 0 0 3 0 0 0 0 0 0 12.0868 -16.6689 0.0000 C 0 0 2 0 0 0 0 0 0 12.7669 -15.5387 0.0000 C 0 0 0 0 0 0 0 0 0 12.0944 -15.1363 0.0000 C 0 0 0 0 0 0 0 0 0 8.8000 -13.2210 0.0000 C 0 0 0 0 0 0 0 0 0 10.1348 -13.2134 0.0000 C 0 0 0 0 0 0 0 0 0 12.7414 -17.0559 0.0000 C 0 0 0 0 0 0 0 0 0 13.4181 -15.9299 0.0000 C 0 0 0 0 0 0 0 0 0 8.1309 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 13.4070 -16.6867 0.0000 C 0 0 1 0 0 0 0 0 0 7.4583 -13.2210 0.0000 C 0 0 0 0 0 0 0 0 0 14.0616 -17.0780 0.0000 O 0 0 0 0 0 0 0 0 0 6.7969 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 6.1202 -13.2210 0.0000 C 0 0 0 0 0 0 0 0 0 6.7969 -14.3794 0.0000 C 0 0 0 0 0 0 0 0 0 5.4544 -13.6046 0.0000 S 0 0 0 0 0 0 0 0 0 6.1167 -12.4419 0.0000 O 0 0 0 0 0 0 0 0 0 4.7742 -13.2134 0.0000 C 0 0 0 0 0 0 0 0 0 4.1017 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 3.4216 -13.2134 0.0000 N 0 0 0 0 0 0 0 0 0 2.7490 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 2.0723 -13.2134 0.0000 C 0 0 0 0 0 0 0 0 0 2.7490 -14.3905 0.0000 O 0 0 0 0 0 0 0 0 0 1.3921 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0.7195 -13.2134 0.0000 N 0 0 0 0 0 0 0 0 0 0.0393 -13.6046 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6332 -13.2134 0.0000 C 0 0 3 0 0 0 0 0 0 0.0393 -14.3905 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3134 -13.6046 0.0000 C 0 0 3 0 0 0 0 0 0 -0.6332 -12.4385 0.0000 O 0 0 0 0 0 0 0 0 0 -1.9935 -13.2134 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3203 -14.3027 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3279 -12.8000 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6626 -13.6046 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4741 -13.6191 0.0000 P 0 0 3 0 0 0 0 0 0 -3.4818 -12.0286 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4852 -14.5440 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2642 -13.6081 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4818 -10.3759 0.0000 P 0 0 3 0 0 0 0 0 0 -2.2348 -10.3572 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4741 -9.5823 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2642 -10.3572 0.0000 O 0 0 0 0 0 0 0 0 0 -1.1676 -9.8568 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4397 -10.0835 0.0000 C 0 0 2 0 0 0 0 0 0 -0.1874 -10.8293 0.0000 C 0 0 2 0 0 0 0 0 0 0.2004 -9.6301 0.0000 O 0 0 0 0 0 0 0 0 0 0.6096 -10.8293 0.0000 C 0 0 2 0 0 0 0 0 0 -0.5855 -11.3961 0.0000 O 0 0 0 0 0 0 0 0 0 0.8474 -10.0945 0.0000 C 0 0 2 0 0 0 0 0 0 1.0707 -11.4583 0.0000 O 0 0 0 0 0 0 0 0 0 -1.4156 -11.3850 0.0000 P 0 0 3 0 0 0 0 0 0 1.1730 -8.7376 0.0000 N 0 0 3 0 0 0 0 0 0 -1.3534 -10.6392 0.0000 O 0 0 0 0 0 0 0 0 0 -2.1760 -11.4072 0.0000 O 0 0 0 0 0 0 0 0 0 -1.4191 -12.1751 0.0000 O 0 0 0 0 0 0 0 0 0 -0.1908 -8.7376 0.0000 C 0 0 0 0 0 0 0 0 0 1.1730 -7.9517 0.0000 C 0 0 0 0 0 0 0 0 0 -0.1908 -7.9517 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8820 -9.1400 0.0000 N 0 0 0 0 0 0 0 0 0 0.4852 -7.5495 0.0000 N 0 0 0 0 0 0 0 0 0 -0.8820 -7.5605 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5546 -8.7376 0.0000 C 0 0 0 0 0 0 0 0 0 -1.5546 -7.9517 0.0000 N 0 0 0 0 0 0 0 0 0 -0.8820 -6.7845 0.0000 N 0 0 0 0 0 0 0 0 0 12.0833 -17.4181 0.0000 H 0 0 0 0 0 0 0 0 0 10.7776 -13.4035 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 3 9 1 0 0 0 4 10 1 0 0 0 5 11 1 0 0 0 5 12 1 0 0 0 6 13 1 0 0 0 6 14 1 1 0 0 7 15 1 0 0 0 11 16 1 0 0 0 11 17 1 0 0 0 11 18 1 0 0 0 15 19 1 0 0 0 15 20 1 0 0 0 16 21 1 0 0 0 17 22 1 0 0 0 19 23 1 0 0 0 21 24 1 0 0 0 23 25 1 0 0 0 24 26 1 1 0 0 25 27 2 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 28 30 1 0 0 0 28 31 2 0 0 0 30 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 35 37 2 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 40 42 2 0 0 0 41 43 1 0 0 0 41 44 1 0 0 0 43 45 1 0 0 0 43 46 1 0 0 0 43 47 1 0 0 0 45 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 49 51 1 0 0 0 49 52 2 0 0 0 50 53 1 0 0 0 53 54 1 0 0 0 53 55 1 0 0 0 53 56 2 0 0 0 54 57 1 0 0 0 58 57 1 1 0 0 58 59 1 0 0 0 58 60 1 0 0 0 59 61 1 0 0 0 59 62 1 6 0 0 60 63 1 0 0 0 61 64 1 6 0 0 62 65 1 0 0 0 63 66 1 1 0 0 65 67 1 0 0 0 65 68 1 0 0 0 65 69 2 0 0 0 66 70 1 0 0 0 66 71 1 0 0 0 70 72 2 0 0 0 70 73 1 0 0 0 71 74 2 0 0 0 72 75 1 0 0 0 73 76 2 0 0 0 75 77 2 0 0 0 75 78 1 0 0 0 7 10 1 0 0 0 8 12 1 0 0 0 13 16 1 0 0 0 22 24 1 0 0 0 61 63 1 0 0 0 72 74 1 0 0 0 76 77 1 0 0 0 16 79 1 6 0 0 8 80 1 1 0 0 M END