Ketcher 07021514492D 1 1.00000 0.00000 0 34 37 0 1 0 999 V2000 -2.6335 -0.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5091 -0.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5091 -2.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6335 -2.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -2.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 -2.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -0.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 0.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0338 0.9851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 0.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7649 -0.8142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3299 -0.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7649 0.7869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 1.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.5109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6411 1.2771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3975 -2.5226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 -0.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9193 -1.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8992 2.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0338 -0.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0338 0.0162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0338 -2.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4965 1.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3621 2.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2279 1.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2279 0.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0937 2.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6307 2.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7649 1.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3621 3.3133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0848 1.3139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11 10 1 0 0 0 14 10 1 0 0 0 9 10 1 0 0 0 10 15 1 1 0 0 23 11 1 0 0 0 12 11 1 0 0 0 11 17 1 6 0 0 8 20 1 0 0 0 7 20 1 0 0 0 23 20 1 0 0 0 25 23 1 0 0 0 5 7 1 0 0 0 7 16 1 1 0 0 1 7 1 0 0 0 13 14 1 0 0 0 32 14 1 0 0 0 14 18 1 6 0 0 8 9 1 0 0 0 13 12 1 0 0 0 6 25 1 0 0 0 4 5 1 0 0 0 6 5 2 0 0 0 2 1 1 0 0 0 3 4 1 0 0 0 3 2 1 0 0 0 3 19 1 1 0 0 20 21 1 6 0 0 32 22 1 6 0 0 23 24 1 1 0 0 31 26 1 0 0 0 27 26 1 0 0 0 28 27 1 0 0 0 29 28 1 0 0 0 30 28 1 0 0 0 31 32 1 0 0 0 27 33 1 6 0 0 28 34 1 0 0 0 M END > CHEBI:86074 > (24S,25)-dihydroxycholesterol > An oxysterol that is cholesterol which is substituted by hydroxy groups at positions 24S and 25. > 3 > cholest-5-en-3beta,24S,25-triol; 24S,25-dihydroxycholesterol > (3beta,24S)-cholest-5-ene-3,24,25-triol > C27H46O3 > 418.65230 > 418.34470 > 0 > C[C@H](CC[C@H](O)C(C)(C)O)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C > InChI=1S/C27H46O3/c1-17(6-11-24(29)25(2,3)30)21-9-10-22-20-8-7-18-16-19(28)12-14-26(18,4)23(20)13-15-27(21,22)5/h7,17,19-24,28-30H,6,8-16H2,1-5H3/t17-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1 > OFNJCHBCBBSWHW-XVYZBDJZSA-N > 2629565 > LMST01010128 > 14640697 $$$$