KEGG:C08630 Lupeol acetate ISISHOST03240423202D 1 1.00000 0.00000 7670 39 43 0 0 0 999 V2000 1.1414 -0.0552 0.0000 C 0 0 2 0 0 0 0 0 0 1.1483 0.7586 0.0000 C 0 0 1 0 0 0 0 0 0 0.4379 -0.4552 0.0000 C 0 0 1 0 0 0 0 0 0 1.8345 -0.4655 0.0000 C 0 0 0 0 0 0 0 0 0 1.1345 -0.8621 0.0000 C 0 0 0 0 0 0 0 0 0 1.8517 1.1483 0.0000 C 0 0 2 0 0 0 0 0 0 0.4517 1.1655 0.0000 C 0 0 0 0 0 0 0 0 0 -0.2586 -0.0448 0.0000 C 0 0 2 0 0 0 0 0 0 0.4379 -1.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0.4310 0.3621 0.0000 C 0 0 0 0 0 0 0 0 0 2.5379 -0.0655 0.0000 C 0 0 0 0 0 0 0 0 0 2.5517 0.7379 0.0000 C 0 0 1 0 0 0 0 0 0 1.8517 1.9586 0.0000 C 0 0 1 0 0 0 0 0 0 -0.2517 0.7690 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9655 -0.4448 0.0000 C 0 0 2 0 0 0 0 0 0 -0.2655 -1.6690 0.0000 C 0 0 0 0 0 0 0 0 0 3.2552 1.1448 0.0000 C 0 0 0 0 0 0 0 0 0 3.2448 0.3379 0.0000 C 0 0 0 0 0 0 0 0 0 3.2552 1.9552 0.0000 C 0 0 0 0 0 0 0 0 0 1.6379 2.7483 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9690 -1.2586 0.0000 C 0 0 1 0 0 0 0 0 0 -1.6655 -0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9759 0.3655 0.0000 C 0 0 0 0 0 0 0 0 0 0.8517 2.9655 0.0000 C 0 0 0 0 0 0 0 0 0 2.2138 3.3276 0.0000 C 0 0 0 0 0 0 0 0 0 -1.6655 -1.6655 0.0000 C 0 0 3 0 0 0 0 0 0 -2.3759 -0.4448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.3759 -1.2586 0.0000 C 0 0 2 0 0 0 0 0 0 -2.0828 -2.3655 0.0000 C 0 0 0 0 0 0 0 0 0 -1.2690 -2.3655 0.0000 C 0 0 0 0 0 0 0 0 0 -3.0793 -1.6621 0.0000 O 0 0 0 0 0 0 0 0 0 -3.7862 -1.2552 0.0000 C 0 0 0 0 0 0 0 0 0 -4.4897 -1.6586 0.0000 C 0 0 0 0 0 0 0 0 0 -3.7897 -0.4414 0.0000 O 0 0 0 0 0 0 0 0 0 1.1414 1.5724 0.0000 H 0 0 0 0 0 0 0 0 0 1.8517 0.3414 0.0000 H 0 0 0 0 0 0 0 0 0 -0.2655 -0.8552 0.0000 H 0 0 0 0 0 0 0 0 0 1.0621 2.1759 0.0000 H 0 0 0 0 0 0 0 0 0 -0.9793 -2.0655 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 2 7 1 0 0 0 3 8 1 0 0 0 3 9 1 0 0 0 3 10 1 1 0 0 4 11 1 0 0 0 6 12 1 0 0 0 6 13 1 0 0 0 7 14 1 0 0 0 8 15 1 0 0 0 9 16 1 0 0 0 12 17 1 0 0 0 12 18 1 1 0 0 13 19 1 0 0 0 13 20 1 6 0 0 15 21 1 0 0 0 15 22 1 0 0 0 15 23 1 1 0 0 20 24 1 0 0 0 20 25 2 0 0 0 21 26 1 0 0 0 22 27 1 0 0 0 26 28 1 0 0 0 26 29 1 0 0 0 26 30 1 0 0 0 28 31 1 1 0 0 31 32 1 0 0 0 32 33 1 0 0 0 32 34 2 0 0 0 8 14 1 0 0 0 11 12 1 0 0 0 16 21 1 0 0 0 17 19 1 0 0 0 27 28 1 0 0 0 2 35 1 1 0 0 6 36 1 6 0 0 8 37 1 6 0 0 13 38 1 1 0 0 21 39 1 6 0 0 M END