KEGG:C04379 9,11alpha-Epoxypregn-4-ene-3,20-dione ISISHOST03240423102D 1 1.00000 0.00000 3792 27 31 0 1 0 999 V2000 -0.2897 -0.1793 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2759 0.5724 0.0000 C 0 0 2 0 0 0 0 0 0 0.3759 -0.5586 0.0000 C 0 0 2 0 0 0 0 0 0 -0.9448 -0.5655 0.0000 C 0 0 2 0 0 0 0 0 0 -0.9310 0.2069 0.0000 O 0 0 0 0 0 0 0 0 0 0.3690 0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 1.0379 -0.1724 0.0000 C 0 0 1 0 0 0 0 0 0 0.3828 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9448 -1.3241 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6035 -0.1897 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4724 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 1.0414 0.5966 0.0000 C 0 0 1 0 0 0 0 0 0 2.3690 -0.1759 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2828 -1.7035 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6035 -1.7069 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2517 -0.5655 0.0000 C 0 0 0 0 0 0 0 0 0 1.7103 0.9793 0.0000 C 0 0 2 0 0 0 0 0 0 0.9586 1.4138 0.0000 C 0 0 0 0 0 0 0 0 0 2.3724 0.5897 0.0000 C 0 0 0 0 0 0 0 0 0 -2.2517 -1.3241 0.0000 C 0 0 0 0 0 0 0 0 0 1.7103 1.7310 0.0000 C 0 0 0 0 0 0 0 0 0 -2.9035 -1.6965 0.0000 O 0 0 0 0 0 0 0 0 0 1.0621 2.1069 0.0000 C 0 0 0 0 0 0 0 0 0 2.3621 2.1000 0.0000 O 0 0 0 0 0 0 0 0 0 0.3724 0.1931 0.0000 H 0 0 0 0 0 0 0 0 0 1.0379 -0.9207 0.0000 H 0 0 0 0 0 0 0 0 0 2.4552 0.9793 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 1 5 1 6 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 4 10 1 0 0 0 4 11 1 1 0 0 6 12 1 0 0 0 7 13 1 0 0 0 8 14 1 0 0 0 9 15 2 0 0 0 10 16 1 0 0 0 12 17 1 0 0 0 12 18 1 1 0 0 13 19 1 0 0 0 15 20 1 0 0 0 17 21 1 1 0 0 20 22 2 0 0 0 21 23 1 0 0 0 21 24 2 0 0 0 2 5 1 6 0 0 7 12 1 0 0 0 9 14 1 0 0 0 16 20 1 0 0 0 17 19 1 0 0 0 3 25 1 1 0 0 7 26 1 6 0 0 17 27 1 6 0 0 M END