HMDB0029495 RDKit 3D Trigoforin 26 27 0 0 0 0 0 0 0 0999 V2000 4.2202 -0.0837 -0.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7507 -0.1864 -0.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -1.3925 -0.1547 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6972 -1.4332 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0083 -0.2507 -0.0514 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3836 -0.3337 0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1068 -1.6258 0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0771 0.8718 0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5426 0.9131 0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3837 2.0679 0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9956 3.1759 0.0334 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0757 2.0810 -0.0607 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6414 0.9827 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0066 0.9724 -0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5324 0.8078 0.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4735 0.0709 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7382 -0.9667 0.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6212 -2.3127 -0.1774 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1523 -2.3485 -0.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1451 -1.4082 0.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6906 -2.3331 0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2268 -2.0630 -0.9401 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8854 1.8850 -0.2786 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8792 0.8262 1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0406 0.1462 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5175 1.9372 -0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 2 0 14 2 1 0 13 5 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 0 4 19 1 0 7 20 1 0 7 21 1 0 7 22 1 0 9 23 1 0 9 24 1 0 9 25 1 0 14 26 1 0 M END