HMDB0033692 RDKit 3D Melilotocarpan D 39 42 0 0 0 0 0 0 0 0999 V2000 6.5116 -0.6997 -1.0258 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2545 -1.0937 -1.5397 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1003 -0.6768 -0.8952 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1708 0.1107 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0651 0.5539 0.9116 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8113 0.2069 0.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7209 -0.5813 -0.6619 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8373 -1.0246 -1.3426 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7552 -1.8279 -2.4904 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3505 -0.8143 -0.9426 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2739 0.3633 -0.4725 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6947 0.2477 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5023 -0.5572 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8665 -0.6586 -0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3712 0.0482 0.4529 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -0.0608 0.7548 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5725 -0.8716 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5216 0.8423 1.1953 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0783 1.5228 2.2487 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1685 0.9690 0.9186 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3187 1.7808 1.6837 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1041 1.7578 1.4772 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4272 0.4494 0.8874 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3376 -1.2220 -1.5522 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6299 -0.9463 0.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6361 0.4185 -1.0903 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 0.3880 0.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1429 1.1800 1.8059 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5801 -2.1446 -2.9775 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 1.2474 -1.0813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0916 -1.0983 -1.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5285 -1.2847 -1.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5629 -0.9145 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1248 -1.8949 -0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6568 -0.4658 -1.0538 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5043 2.1096 2.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5577 1.8792 2.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3952 2.6227 0.8622 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 -0.3544 1.5342 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 2 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 1 0 22 23 1 0 8 3 1 0 23 11 1 0 23 6 1 0 20 12 1 0 1 24 1 0 1 25 1 0 1 26 1 0 4 27 1 0 5 28 1 0 9 29 1 0 11 30 1 0 13 31 1 0 14 32 1 0 17 33 1 0 17 34 1 0 17 35 1 0 19 36 1 0 22 37 1 0 22 38 1 0 23 39 1 0 M END