LMST04030253 LIPID_MAPS_STRUCTURE_DATABASE 83 89 0 0 0 999 V2000 12.1882 8.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1821 10.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2293 10.3419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2391 9.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1450 10.3529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1412 9.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0467 9.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0506 10.3462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0997 10.9034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1851 9.7761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1102 11.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0878 11.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0359 12.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1011 13.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9644 11.9714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8969 12.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8256 11.9650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7579 12.4988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1399 8.1823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8256 10.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2921 8.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2921 7.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2391 7.0566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1882 7.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3512 9.2399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4102 8.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4102 7.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3512 7.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2921 9.7831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4693 7.0671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0386 11.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2491 12.5011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2391 8.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1484 7.0464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7167 11.9407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 13.6082 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 26.2367 20.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4963 21.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.9539 19.9082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7558 20.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0387 19.9082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4919 19.1676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9601 14.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7684 14.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9601 15.8377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1675 16.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3748 15.8377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9916 17.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1675 17.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9916 18.5836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4063 18.5836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1990 19.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7844 19.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5339 21.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9916 20.4144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4493 21.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1990 19.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4062 20.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5770 20.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4075 20.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.2381 20.4144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4923 21.3296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4923 19.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3228 21.3296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3228 19.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4923 20.4144 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 22.3228 20.4144 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 23.8853 21.0616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5006 19.1676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.5853 18.2523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.4159 18.2523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.5006 18.2523 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 24.5006 17.3370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1072 21.0616 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 27.7875 20.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.4795 21.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5800 20.9066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7875 19.5337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.3898 21.8020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.3727 20.4492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5801 19.0763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3727 19.5339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 30.1654 20.9068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 5 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 6 7 1 0 0 0 0 1 10 1 1 0 0 0 5 11 1 1 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 1 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 1 0 0 0 6 19 1 6 0 0 0 17 20 1 0 0 0 0 4 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 1 1 0 0 0 0 21 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 22 2 0 0 0 0 21 29 1 1 0 0 0 27 30 2 0 0 0 0 9 31 1 6 0 0 0 12 32 1 6 0 0 0 4 33 1 6 0 0 0 24 34 1 6 0 0 18 35 2 0 0 0 18 36 1 0 0 0 37 74 1 1 0 0 0 38 37 1 0 0 0 0 39 37 1 0 0 0 0 40 38 1 0 0 0 0 41 39 1 0 0 0 0 39 42 1 6 0 0 0 40 68 1 1 0 0 0 41 40 1 0 0 0 0 41 69 1 6 0 0 0 49 46 1 0 0 0 0 46 45 1 0 0 0 0 45 43 1 0 0 0 0 43 44 1 0 0 0 0 46 47 2 0 0 0 0 48 50 1 0 0 0 0 52 50 1 0 0 0 0 49 48 1 0 0 0 0 52 51 2 0 0 0 0 52 57 1 0 0 0 0 57 55 1 0 0 0 0 55 53 1 0 0 0 0 53 59 1 0 0 0 0 55 54 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 6 0 0 0 59 66 1 0 0 0 0 66 60 1 0 0 0 0 60 67 1 0 0 0 0 67 61 1 0 0 0 0 66 62 2 0 0 0 0 66 63 1 0 0 0 0 67 64 2 0 0 0 0 67 65 1 0 0 0 0 68 61 1 0 0 0 0 69 72 1 0 0 0 0 72 70 1 0 0 0 0 72 71 1 0 0 0 0 72 73 2 0 0 0 0 75 74 1 0 0 0 0 76 74 1 0 0 0 0 77 75 2 0 0 0 0 78 75 1 0 0 0 0 79 76 2 0 0 0 0 80 77 1 0 0 0 0 79 77 1 0 0 0 0 81 78 2 0 0 0 0 82 80 2 0 0 0 0 83 80 1 0 0 0 0 82 81 1 0 0 0 0 44 36 1 0 0 0 0 M END > LMST04030253 > (25S)-7alpha-hydroxy-3-oxo-4-cholestenoyl CoA > 7alpha-hydroxy-3-oxocholest-4-en-(25S)26-oyl CoA > C48H76N7O19P3S > 1179.41 > Sterol Lipids [ST] > Bile acids and derivatives [ST04] > C27 bile acids, alcohols, and derivatives [ST0403] > - > > - > - > - > - > - > - > - > - > - > 163191885 > - > - > Active > - > https://lipidmaps.org/index.php/databases/lmsd/LMST04030253 $$$$