KEGG:C04644 3alpha,7alpha-Dihydroxy-5beta-cholestanoyl-CoA ISISHOST03240423102D 1 1.00000 0.00000 4018 79 85 0 0 0 999 V2000 10.0815 -15.5768 0.0000 C 0 0 3 0 0 0 0 0 0 10.7637 -15.9708 0.0000 C 0 0 3 0 0 0 0 0 0 10.0815 -14.7889 0.0000 C 0 0 1 0 0 0 0 0 0 8.7206 -15.5845 0.0000 C 0 0 0 0 0 0 0 0 0 11.4424 -15.5879 0.0000 C 0 0 3 0 0 0 0 0 0 10.7526 -16.6862 0.0000 C 0 0 1 0 0 0 0 0 0 9.3993 -14.3949 0.0000 C 0 0 3 0 0 0 0 0 0 10.7672 -14.3984 0.0000 C 0 0 0 0 0 0 0 0 0 10.0849 -14.0155 0.0000 C 0 0 0 0 0 0 0 0 0 8.7172 -14.7958 0.0000 C 0 0 0 0 0 0 0 0 0 12.1135 -15.9819 0.0000 C 0 0 2 0 0 0 0 0 0 11.4279 -14.7779 0.0000 C 0 0 0 0 0 0 0 0 0 11.4348 -17.1458 0.0000 C 0 0 0 0 0 0 0 0 0 10.1139 -17.1749 0.0000 O 0 0 0 0 0 0 0 0 0 9.3917 -13.6250 0.0000 C 0 0 3 0 0 0 0 0 0 12.1135 -16.7553 0.0000 C 0 0 2 0 0 0 0 0 0 12.7846 -15.5914 0.0000 C 0 0 0 0 0 0 0 0 0 12.1169 -15.2085 0.0000 C 0 0 0 0 0 0 0 0 0 12.7846 -17.1492 0.0000 C 0 0 0 0 0 0 0 0 0 13.4523 -15.9819 0.0000 C 0 0 0 0 0 0 0 0 0 13.4523 -16.7553 0.0000 C 0 0 1 0 0 0 0 0 0 14.1165 -17.1348 0.0000 O 0 0 0 0 0 0 0 0 0 12.1169 -17.5253 0.0000 H 0 0 0 0 0 0 0 0 0 5.4254 -13.6258 0.0000 S 0 0 0 0 0 0 0 0 0 4.7612 -13.2352 0.0000 C 0 0 0 0 0 0 0 0 0 4.0970 -13.6258 0.0000 C 0 0 0 0 0 0 0 0 0 3.4293 -13.2352 0.0000 N 0 0 0 0 0 0 0 0 0 2.7693 -13.6258 0.0000 C 0 0 0 0 0 0 0 0 0 2.1016 -13.2352 0.0000 C 0 0 0 0 0 0 0 0 0 2.7693 -14.3880 0.0000 O 0 0 0 0 0 0 0 0 0 1.4374 -13.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0.7732 -13.2352 0.0000 N 0 0 0 0 0 0 0 0 0 0.1096 -13.6258 0.0000 C 0 0 0 0 0 0 0 0 0 -0.5581 -13.2352 0.0000 C 0 0 3 0 0 0 0 0 0 0.1096 -14.3880 0.0000 O 0 0 0 0 0 0 0 0 0 -1.7151 -13.6402 0.0000 C 0 0 3 0 0 0 0 0 0 -0.5581 -12.4763 0.0000 O 0 0 0 0 0 0 0 0 0 -2.3717 -13.2497 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7005 -14.2823 0.0000 C 0 0 0 0 0 0 0 0 0 -1.7005 -12.8447 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0393 -13.6402 0.0000 O 0 0 0 0 0 0 0 0 0 -3.8384 -13.6547 0.0000 P 0 0 3 0 0 0 0 0 0 -3.8384 -12.0823 0.0000 O 0 0 0 0 0 0 0 0 0 -3.8453 -14.5595 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6118 -13.6402 0.0000 O 0 0 0 0 0 0 0 0 0 -3.8384 -10.4587 0.0000 P 0 0 3 0 0 0 0 0 0 -2.6198 -10.4401 0.0000 O 0 0 0 0 0 0 0 0 0 -3.8384 -9.6853 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6118 -10.4401 0.0000 O 0 0 0 0 0 0 0 0 0 -1.5651 -9.9480 0.0000 C 0 0 0 0 0 0 0 0 0 -0.8428 -10.1740 0.0000 C 0 0 2 0 0 0 0 0 0 -0.6023 -10.9073 0.0000 C 0 0 2 0 0 0 0 0 0 -0.2228 -9.7254 0.0000 O 0 0 0 0 0 0 0 0 0 0.1822 -10.9073 0.0000 C 0 0 2 0 0 0 0 0 0 -0.9962 -11.4547 0.0000 O 0 0 0 0 0 0 0 0 0 0.4158 -10.1850 0.0000 C 0 0 2 0 0 0 0 0 0 0.6349 -11.5315 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8133 -11.4547 0.0000 P 0 0 3 0 0 0 0 0 0 0.7331 -8.8497 0.0000 N 0 0 3 0 0 0 0 0 0 -1.7552 -10.7214 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5611 -11.4693 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8167 -12.2281 0.0000 O 0 0 0 0 0 0 0 0 0 -0.6134 -8.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0.7331 -8.0763 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6134 -8.0763 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2845 -9.2436 0.0000 N 0 0 0 0 0 0 0 0 0 0.0620 -7.6858 0.0000 N 0 0 0 0 0 0 0 0 0 -1.2845 -7.6892 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9522 -8.8497 0.0000 C 0 0 0 0 0 0 0 0 0 -1.9522 -8.0763 0.0000 N 0 0 0 0 0 0 0 0 0 -1.2845 -6.9405 0.0000 N 0 0 0 0 0 0 0 0 0 6.0875 -13.2417 0.0000 C 0 0 0 0 0 0 0 0 0 6.7500 -13.6250 0.0000 C 0 0 3 0 0 0 0 0 0 7.4125 -13.2417 0.0000 C 0 0 0 0 0 0 0 0 0 8.0750 -13.6250 0.0000 C 0 0 0 0 0 0 0 0 0 6.7458 -14.3875 0.0000 C 0 0 0 0 0 0 0 0 0 6.0871 -12.4762 0.0000 O 0 0 0 0 0 0 0 0 0 8.7333 -13.2458 0.0000 C 0 0 0 0 0 0 0 0 0 10.0500 -13.2458 0.0000 C 0 0 0 0 0 0 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 6 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 6 0 0 16 19 1 0 0 0 17 20 1 0 0 0 19 21 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 28 30 2 0 0 0 29 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 33 35 2 0 0 0 34 36 1 0 0 0 34 37 1 0 0 0 36 38 1 0 0 0 36 39 1 0 0 0 36 40 1 0 0 0 38 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 42 44 1 0 0 0 42 45 2 0 0 0 43 46 1 0 0 0 46 47 1 0 0 0 46 48 1 0 0 0 46 49 2 0 0 0 47 50 1 0 0 0 51 50 1 1 0 0 51 52 1 0 0 0 51 53 1 0 0 0 52 54 1 0 0 0 52 55 1 6 0 0 53 56 1 0 0 0 54 57 1 6 0 0 55 58 1 0 0 0 56 59 1 1 0 0 58 60 1 0 0 0 58 61 1 0 0 0 58 62 2 0 0 0 59 63 1 0 0 0 59 64 1 0 0 0 63 65 2 0 0 0 63 66 1 0 0 0 64 67 2 0 0 0 65 68 1 0 0 0 66 69 2 0 0 0 68 70 2 0 0 0 68 71 1 0 0 0 54 56 1 0 0 0 65 67 1 0 0 0 69 70 1 0 0 0 21 22 1 1 0 0 24 72 1 0 0 0 7 10 1 0 0 0 72 73 1 0 0 0 8 12 1 0 0 0 73 74 1 0 0 0 13 16 1 0 0 0 74 75 1 0 0 0 20 21 1 0 0 0 73 76 1 0 0 0 16 23 1 6 0 0 72 77 2 0 0 0 75 78 1 0 0 0 78 15 1 0 0 0 1 2 1 0 0 0 15 79 1 0 0 0 M END