KEGG:C10214 Chebulagic acid ISISHOST03240423252D 1 1.00000 0.00000 9256 69 76 0 1 0 999 V2000 16.2363 -15.6780 0.0000 O 0 0 0 0 0 0 0 0 0 15.4174 -15.6780 0.0000 C 0 0 0 0 0 0 0 0 0 15.9654 -14.1490 0.0000 C 0 0 2 0 0 0 0 0 0 16.6415 -13.7531 0.0000 C 0 0 2 0 0 0 0 0 0 15.2963 -13.7531 0.0000 C 0 0 1 0 0 0 0 0 0 16.6415 -12.9797 0.0000 C 0 0 1 0 0 0 0 0 0 17.3181 -14.1789 0.0000 O 0 0 0 0 0 0 0 0 0 15.2963 -12.9797 0.0000 C 0 0 2 0 0 0 0 0 0 15.9624 -14.9581 0.0000 O 0 0 0 0 0 0 0 0 0 15.9654 -12.5948 0.0000 O 0 0 0 0 0 0 0 0 0 17.3216 -12.5948 0.0000 O 0 0 0 0 0 0 0 0 0 17.3181 -14.9598 0.0000 C 0 0 0 0 0 0 0 0 0 14.6299 -12.5948 0.0000 C 0 0 0 0 0 0 0 0 0 14.1873 -15.6336 0.0000 C 0 0 0 0 0 0 0 0 0 17.9948 -12.2066 0.0000 C 0 0 0 0 0 0 0 0 0 17.9872 -15.3482 0.0000 C 0 0 0 0 0 0 0 0 0 16.6449 -15.3482 0.0000 O 0 0 0 0 0 0 0 0 0 14.0339 -13.0943 0.0000 O 0 0 0 0 0 0 0 0 0 13.3724 -15.6428 0.0000 C 0 0 0 0 0 0 0 0 0 14.3983 -16.2607 0.0000 O 0 0 0 0 0 0 0 0 0 18.6640 -12.5983 0.0000 C 0 0 0 0 0 0 0 0 0 17.9983 -11.4332 0.0000 O 0 0 0 0 0 0 0 0 0 18.6606 -14.9598 0.0000 C 0 0 0 0 0 0 0 0 0 13.3607 -12.7018 0.0000 C 0 0 0 0 0 0 0 0 0 13.3724 -16.4346 0.0000 C 0 0 0 0 0 0 0 0 0 12.7041 -15.2544 0.0000 C 0 0 0 0 0 0 0 0 0 18.6640 -13.3820 0.0000 C 0 0 0 0 0 0 0 0 0 19.3475 -12.2100 0.0000 C 0 0 0 0 0 0 0 0 0 19.3441 -15.3482 0.0000 C 0 0 0 0 0 0 0 0 0 12.6916 -13.0943 0.0000 C 0 0 0 0 0 0 0 0 0 13.3607 -11.9250 0.0000 O 0 0 0 0 0 0 0 0 0 12.7041 -16.8258 0.0000 C 0 0 0 0 0 0 0 0 0 12.0204 -15.6428 0.0000 C 0 0 0 0 0 0 0 0 0 19.3475 -13.7773 0.0000 C 0 0 0 0 0 0 0 0 0 20.0166 -12.5983 0.0000 C 0 0 0 0 0 0 0 0 0 19.3441 -16.1319 0.0000 C 0 0 0 0 0 0 0 0 0 20.0132 -14.9564 0.0000 O 0 0 0 0 0 0 0 0 0 12.6916 -13.8786 0.0000 C 0 0 0 0 0 0 0 0 0 12.0224 -12.7018 0.0000 C 0 0 0 0 0 0 0 0 0 12.0204 -16.4346 0.0000 C 0 0 0 0 0 0 0 0 0 12.7075 -17.6025 0.0000 O 0 0 0 0 0 0 0 0 0 11.3472 -15.2544 0.0000 O 0 0 0 0 0 0 0 0 0 20.0028 -13.3537 0.0000 C 0 0 0 0 0 0 0 0 0 19.3475 -14.5545 0.0000 O 0 0 0 0 0 0 0 0 0 20.6900 -12.2100 0.0000 O 0 0 0 0 0 0 0 0 0 20.0166 -16.5208 0.0000 O 0 0 0 0 0 0 0 0 0 12.0224 -14.2774 0.0000 C 0 0 0 0 0 0 0 0 0 11.3389 -13.0943 0.0000 C 0 0 0 0 0 0 0 0 0 11.3472 -16.8154 0.0000 O 0 0 0 0 0 0 0 0 0 20.6934 -13.7635 0.0000 O 0 0 0 0 0 0 0 0 0 11.3389 -13.8786 0.0000 C 0 0 0 0 0 0 0 0 0 12.0224 -15.0505 0.0000 O 0 0 0 0 0 0 0 0 0 10.6656 -12.6984 0.0000 O 0 0 0 0 0 0 0 0 0 10.6622 -14.2670 0.0000 O 0 0 0 0 0 0 0 0 0 18.6606 -16.5311 0.0000 C 0 0 0 0 0 0 0 0 0 17.9917 -16.1298 0.0000 C 0 0 0 0 0 0 0 0 0 17.3123 -16.5128 0.0000 C 0 0 1 0 0 0 0 0 0 17.3017 -17.2890 0.0000 C 0 0 1 0 0 0 0 0 0 17.9705 -17.6862 0.0000 C 0 0 0 0 0 0 0 0 0 18.6500 -17.3073 0.0000 O 0 0 0 0 0 0 0 0 0 17.9595 -18.4945 0.0000 O 0 0 0 0 0 0 0 0 0 14.5919 -14.1530 0.0000 O 0 0 0 0 0 0 0 0 0 16.5943 -17.6836 0.0000 O 0 0 0 0 0 0 0 0 0 15.4203 -16.4969 0.0000 C 0 0 2 0 0 0 0 0 0 14.7625 -16.9654 0.0000 C 0 0 0 0 0 0 0 0 0 14.7649 -17.7239 0.0000 C 0 0 0 0 0 0 0 0 0 14.1109 -18.1032 0.0000 O 0 0 0 0 0 0 0 0 0 15.4212 -18.0991 0.0000 O 0 0 0 0 0 0 0 0 0 17.1333 -15.8750 0.0000 H 0 0 0 0 0 0 0 0 0 12 17 2 0 0 0 13 18 1 0 0 0 14 19 1 0 0 0 14 20 2 0 0 0 15 21 1 0 0 0 15 22 2 0 0 0 16 56 1 0 0 0 16 23 2 0 0 0 18 24 1 0 0 0 19 25 1 0 0 0 19 26 2 0 0 0 21 27 2 0 0 0 21 28 1 0 0 0 23 29 1 0 0 0 24 30 1 0 0 0 24 31 2 0 0 0 25 32 2 0 0 0 26 33 1 0 0 0 27 34 1 0 0 0 28 35 2 0 0 0 55 36 1 0 0 0 29 37 1 0 0 0 30 38 1 0 0 0 30 39 2 0 0 0 32 40 1 0 0 0 32 41 1 0 0 0 33 42 1 0 0 0 34 43 2 0 0 0 34 44 1 0 0 0 35 45 1 0 0 0 36 46 1 0 0 0 38 47 2 0 0 0 39 48 1 0 0 0 40 49 1 0 0 0 43 50 1 0 0 0 47 51 1 0 0 0 47 52 1 0 0 0 48 53 1 0 0 0 51 54 1 0 0 0 8 10 1 0 0 0 29 36 2 0 0 0 33 40 2 0 0 0 35 43 1 0 0 0 48 51 2 0 0 0 38 26 1 0 0 0 1 2 2 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 4 7 1 6 0 0 55 56 2 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 0 0 0 60 55 1 0 0 0 5 8 1 0 0 0 59 61 2 0 0 0 6 10 1 0 0 0 5 62 1 6 0 0 62 2 1 0 0 0 3 9 1 1 0 0 6 11 1 1 0 0 58 63 1 1 0 0 57 64 1 0 0 0 7 12 1 0 0 0 2 64 1 0 0 0 8 13 1 1 0 0 64 65 1 6 0 0 9 14 1 0 0 0 65 66 1 0 0 0 11 15 1 0 0 0 66 67 1 0 0 0 12 16 1 0 0 0 66 68 2 0 0 0 57 69 1 6 0 0 M END