KEGG:C02927 2-Caffeoylisocitrate ISISHOST03240423072D 1 1.00000 0.00000 2583 25 25 0 0 0 999 V2000 0.9724 0.4931 0.0000 C 0 0 3 0 0 0 0 0 0 1.6862 0.9069 0.0000 C 0 0 3 0 0 0 0 0 0 0.2586 0.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0.9724 -0.3310 0.0000 C 0 0 0 0 0 0 0 0 0 1.6897 1.7310 0.0000 C 0 0 0 0 0 0 0 0 0 2.4000 0.4931 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4552 0.4966 0.0000 C 0 0 0 0 0 0 0 0 0 1.6862 -0.7448 0.0000 O 0 0 0 0 0 0 0 0 0 0.2552 -0.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0.9759 2.1448 0.0000 C 0 0 0 0 0 0 0 0 0 2.4000 -0.3345 0.0000 O 0 0 0 0 0 0 0 0 0 3.1172 0.9034 0.0000 O 0 0 0 0 0 0 0 0 0 -1.1690 0.9103 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4586 -0.3310 0.0000 O 0 0 0 0 0 0 0 0 0 0.9759 2.9690 0.0000 O 0 0 0 0 0 0 0 0 0 0.2586 1.7310 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8862 0.4966 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8862 -0.3276 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1759 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6034 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 -1.1759 -1.5655 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6034 -1.5655 0.0000 C 0 0 0 0 0 0 0 0 0 -1.8862 -1.9793 0.0000 C 0 0 0 0 0 0 0 0 0 -0.4586 -1.9759 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8862 -2.8034 0.0000 O 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 4 8 1 0 0 0 4 9 2 0 0 0 5 10 1 0 0 0 6 11 1 0 0 0 6 12 2 0 0 0 7 13 1 0 0 0 7 14 2 0 0 0 10 15 1 0 0 0 10 16 2 0 0 0 13 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 19 21 1 0 0 0 20 22 2 0 0 0 21 23 2 0 0 0 21 24 1 0 0 0 23 25 1 0 0 0 22 23 1 0 0 0 M END