KEGG:C08972 Quillaic acid ISISHOST03240423212D 1 1.00000 0.00000 8012 38 42 0 0 0 999 V2000 7.3734 -11.2783 0.0000 C 0 0 1 0 0 0 0 0 0 6.6665 -10.8542 0.0000 C 0 0 2 0 0 0 0 0 0 7.3665 -12.1025 0.0000 C 0 0 1 0 0 0 0 0 0 8.0941 -10.8749 0.0000 C 0 0 0 0 0 0 0 0 0 8.0872 -11.6887 0.0000 C 0 0 0 0 0 0 0 0 0 5.9458 -11.2611 0.0000 C 0 0 0 0 0 0 0 0 0 6.6768 -10.0335 0.0000 C 0 0 0 0 0 0 0 0 0 6.6458 -12.5059 0.0000 C 0 0 0 0 0 0 0 0 0 7.3596 -12.9301 0.0000 O 0 0 0 0 0 0 0 0 0 8.1044 -10.0507 0.0000 C 0 0 0 0 0 0 0 0 0 5.9355 -12.0852 0.0000 C 0 0 1 0 0 0 0 0 0 5.2320 -10.8404 0.0000 C 0 0 0 0 0 0 0 0 0 7.3975 -9.6335 0.0000 C 0 0 3 0 0 0 0 0 0 5.2182 -12.4921 0.0000 C 0 0 1 0 0 0 0 0 0 5.9286 -12.9094 0.0000 C 0 0 0 0 0 0 0 0 0 4.5148 -11.2508 0.0000 C 0 0 0 0 0 0 0 0 0 7.8044 -8.9094 0.0000 C 0 0 0 0 0 0 0 0 0 7.1803 -8.8266 0.0000 C 0 0 0 0 0 0 0 0 0 4.5079 -12.0749 0.0000 C 0 0 2 0 0 0 0 0 0 5.2182 -13.3197 0.0000 C 0 0 0 0 0 0 0 0 0 5.2113 -11.6611 0.0000 C 0 0 0 0 0 0 0 0 0 3.7872 -12.4852 0.0000 C 0 0 2 0 0 0 0 0 0 4.5010 -13.7335 0.0000 C 0 0 0 0 0 0 0 0 0 3.7837 -13.3163 0.0000 C 0 0 1 0 0 0 0 0 0 3.0734 -12.0749 0.0000 C 0 0 0 0 0 0 0 0 0 3.7803 -11.6576 0.0000 C 0 0 0 0 0 0 0 0 0 3.0734 -13.7301 0.0000 C 0 0 1 0 0 0 0 0 0 2.3527 -12.4852 0.0000 C 0 0 0 0 0 0 0 0 0 2.3527 -13.3163 0.0000 C 0 0 2 0 0 0 0 0 0 3.2837 -14.5301 0.0000 C 0 0 0 0 0 0 0 0 0 2.6492 -14.4473 0.0000 C 0 0 0 0 0 0 0 0 0 1.6355 -13.7335 0.0000 O 0 0 0 0 0 0 0 0 0 6.6596 -11.6783 0.0000 H 0 0 0 0 0 0 0 0 0 4.5010 -12.8956 0.0000 H 0 0 0 0 0 0 0 0 0 3.7803 -14.1370 0.0000 H 0 0 0 0 0 0 0 0 0 8.7958 -11.2708 0.0000 O 0 0 0 0 0 0 0 0 0 8.0792 -12.5125 0.0000 O 0 0 0 0 0 0 0 0 0 3.6917 -15.2417 0.0000 O 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 1 5 1 1 0 0 2 6 1 0 0 0 2 7 1 0 0 0 3 8 1 0 0 0 3 9 1 6 0 0 4 10 1 0 0 0 6 11 1 0 0 0 6 12 2 0 0 0 7 13 1 0 0 0 11 14 1 0 0 0 11 15 1 6 0 0 12 16 1 0 0 0 13 17 1 0 0 0 13 18 1 0 0 0 14 19 1 0 0 0 14 20 1 0 0 0 14 21 1 1 0 0 19 22 1 0 0 0 20 23 1 0 0 0 22 24 1 0 0 0 22 25 1 0 0 0 22 26 1 1 0 0 24 27 1 0 0 0 25 28 1 0 0 0 27 29 1 0 0 0 27 30 1 6 0 0 27 31 1 1 0 0 29 32 1 1 0 0 8 11 1 0 0 0 10 13 1 0 0 0 16 19 1 0 0 0 23 24 1 0 0 0 28 29 1 0 0 0 2 33 1 1 0 0 19 34 1 6 0 0 24 35 1 6 0 0 5 36 1 0 0 0 1 2 1 0 0 0 5 37 2 0 0 0 1 3 1 0 0 0 30 38 2 0 0 0 M END