HMDB0059878 RDKit 3D alpha-Curcumene 37 37 0 0 0 0 0 0 0 0999 V2000 3.9362 0.8879 -0.6614 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6002 -0.0178 0.4534 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3141 0.2198 1.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7209 -0.9775 0.3028 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0425 -1.1682 -0.9983 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5382 -1.1924 -0.8647 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0281 0.0545 -0.3078 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2937 1.2304 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4702 0.0284 -0.0676 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -0.1668 -1.0549 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7523 -0.1850 -0.7915 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2283 -0.0031 0.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6604 -0.0170 0.8264 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3016 0.1932 1.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 0.2058 1.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2377 0.2467 -1.5351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 1.5484 -0.8735 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8547 1.5053 -0.4106 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9266 -0.4993 2.4794 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4063 0.0031 1.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 1.2764 2.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4869 -1.6410 1.1424 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3901 -0.4818 -1.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3636 -2.2023 -1.3347 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2982 -2.0745 -0.2067 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1446 -1.4715 -1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4859 0.2323 0.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6633 1.6002 -1.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7338 2.0771 -0.6456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9291 0.8958 -2.0486 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0366 -0.3069 -2.0592 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4792 -0.3391 -1.5751 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1554 0.9564 0.7224 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7700 -0.3352 1.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -0.7795 0.1854 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6724 0.3328 2.5094 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2535 0.3643 2.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 2 0 15 9 1 0 1 16 1 0 1 17 1 0 1 18 1 0 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 8 28 1 0 8 29 1 0 8 30 1 0 10 31 1 0 11 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 14 36 1 0 15 37 1 0 M END