HMDB0029386 RDKit 3D Indicaxanthin 38 39 0 0 0 0 0 0 0 0999 V2000 4.0016 -3.5207 -0.9468 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3768 -2.3762 -0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7291 -2.1466 -0.3923 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4038 -1.2963 -0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1221 -1.5452 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1502 -0.4740 -0.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1631 -0.7485 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 0.3358 -0.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3648 0.0397 -0.2520 N 0 0 0 0 0 4 0 0 0 0 0 0 -2.9423 -1.2583 -0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2773 -1.1558 0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3386 0.2352 0.8796 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4426 0.9777 -0.0905 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2117 1.1422 -1.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 0.5439 -1.6024 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 2.0106 -2.3147 O 0 0 0 0 0 1 0 0 0 0 0 0 1.5311 0.9380 -0.2529 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9975 1.1798 -0.3229 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3393 2.2800 0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2036 2.1820 1.5201 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6622 3.4819 0.4779 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8075 0.0131 -0.0214 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1339 -2.6016 0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8123 -2.5337 -0.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4408 -1.7675 -0.5704 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7683 1.3746 -0.1179 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3437 -2.0942 0.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1947 -1.4427 -1.4857 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1181 -1.4000 -0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2835 -1.8580 1.1879 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8429 0.2631 1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3502 0.6742 0.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1088 1.9523 0.3163 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1439 1.2997 0.7103 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0356 1.5191 -1.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.5499 -1.3432 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8557 4.1043 -0.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6991 0.1223 0.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 6 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 22 1 0 22 4 1 0 13 9 1 0 3 23 1 0 5 24 1 0 7 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 12 32 1 0 13 33 1 0 17 34 1 0 17 35 1 0 18 36 1 0 21 37 1 0 22 38 1 0 M CHG 2 9 1 16 -1 M END