KEGG:C04554 3alpha,7alpha-Dihydroxy-5beta-cholestanate ISISHOST03240423102D 1 1.00000 0.00000 3935 33 36 0 1 0 999 V2000 0.0966 -0.4138 0.0000 C 0 0 3 0 0 0 0 0 0 -0.5655 -0.8034 0.0000 C 0 0 3 0 0 0 0 0 0 0.1000 0.3552 0.0000 C 0 0 1 0 0 0 0 0 0 1.4276 -0.4207 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2310 -0.4207 0.0000 C 0 0 3 0 0 0 0 0 0 -0.5793 -1.5897 0.0000 C 0 0 1 0 0 0 0 0 0 0.7655 0.7379 0.0000 C 0 0 3 0 0 0 0 0 0 -0.5724 0.7345 0.0000 C 0 0 0 0 0 0 0 0 0 0.0931 1.1069 0.0000 C 0 0 0 0 0 0 0 0 0 1.4310 0.3483 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8862 -0.8069 0.0000 C 0 0 2 0 0 0 0 0 0 -1.2379 0.3448 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2241 -1.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0.0655 -1.9759 0.0000 O 0 0 0 0 0 0 0 0 0 0.7690 1.4897 0.0000 C 0 0 1 0 0 0 0 0 0 -1.8862 -1.5655 0.0000 C 0 0 2 0 0 0 0 0 0 -2.5448 -0.4310 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8897 -0.0552 0.0000 C 0 0 0 0 0 0 0 0 0 1.4207 1.8621 0.0000 C 0 0 0 0 0 0 0 0 0 0.1207 1.8655 0.0000 C 0 0 0 0 0 0 0 0 0 -2.5448 -1.9483 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1931 -0.8069 0.0000 C 0 0 0 0 0 0 0 0 0 2.0690 1.4828 0.0000 C 0 0 0 0 0 0 0 0 0 -3.1931 -1.5655 0.0000 C 0 0 1 0 0 0 0 0 0 2.0690 0.7345 0.0000 C 0 0 0 0 0 0 0 0 0 -3.8448 -1.9379 0.0000 O 0 0 0 0 0 0 0 0 0 2.8172 0.7345 0.0000 C 0 0 3 0 0 0 0 0 0 3.1931 1.3828 0.0000 C 0 0 0 0 0 0 0 0 0 3.1931 0.0862 0.0000 C 0 0 0 0 0 0 0 0 0 3.9414 1.3828 0.0000 O 0 0 0 0 0 0 0 0 0 2.8172 2.0345 0.0000 O 0 0 0 0 0 0 0 0 0 0.7690 2.2379 0.0000 H 0 0 0 0 0 0 0 0 0 -1.8897 -2.3138 0.0000 H 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 1 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 6 0 0 7 15 1 0 0 0 11 16 1 0 0 0 11 17 1 0 0 0 11 18 1 1 0 0 15 19 1 0 0 0 15 20 1 6 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 6 0 0 25 27 1 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 7 10 1 0 0 0 8 12 1 0 0 0 13 16 1 0 0 0 22 24 1 0 0 0 15 32 1 1 0 0 16 33 1 1 0 0 M END