HMDB0004096 RDKit 3D 5-Methoxyindoleacetate 26 27 0 0 0 0 0 0 0 0999 V2000 -3.6575 1.8419 -1.0349 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3751 1.3492 -1.2808 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6456 0.6092 -0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1514 0.3113 0.8752 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3814 -0.4344 1.7539 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1161 -0.9078 1.4611 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8206 -1.6350 2.1077 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8917 -1.7943 1.2991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6305 -1.1543 0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4916 -1.0300 -1.1098 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 0.3235 -1.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7182 0.7002 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8898 1.1873 -2.1328 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3534 -0.5796 0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3733 0.1552 -0.7106 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2372 1.0968 -0.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7055 2.8147 -0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1985 1.9833 -2.0106 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1537 0.6589 1.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7957 -0.6647 2.7232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7358 -2.0108 3.0673 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8037 -2.3259 1.5221 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2439 -1.8509 -1.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8408 -1.1194 -2.0283 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2641 2.1033 -2.2425 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0422 0.3724 -1.6713 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 9 14 1 0 14 15 2 0 15 3 1 0 14 6 1 0 1 16 1 0 1 17 1 0 1 18 1 0 4 19 1 0 5 20 1 0 7 21 1 0 8 22 1 0 10 23 1 0 10 24 1 0 13 25 1 0 15 26 1 0 M END