HMDB0038279 RDKit 3D cis-3-Hexenyl tiglate 31 30 0 0 0 0 0 0 0 0999 V2000 5.0628 -0.0365 0.2576 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6687 0.4637 0.3603 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7177 -0.0907 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -1.2039 -1.2717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3284 0.3906 -0.2841 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4801 -0.1824 -1.0066 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9651 1.4242 0.5509 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3793 1.8315 0.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3174 0.7460 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7191 1.1558 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7049 0.5938 0.4185 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4778 -0.5407 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2632 -1.7753 -0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4995 0.4133 -0.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1159 -1.1324 0.1408 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6832 0.2735 1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4759 1.2750 1.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4605 -2.0380 -0.6342 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2104 -1.5621 -1.8102 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8556 -0.9062 -2.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4482 2.7438 1.1939 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6622 2.0201 -0.4891 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1063 -0.2456 0.6371 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0092 0.5989 2.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9765 1.9942 1.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7147 0.9929 0.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9412 -0.2577 -1.4887 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 -0.7394 -0.7623 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3157 -1.7824 1.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3199 -1.7280 -0.4218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8363 -2.6961 -0.4923 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 3 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 4 18 1 0 4 19 1 0 4 20 1 0 8 21 1 0 8 22 1 0 9 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 12 27 1 0 12 28 1 0 13 29 1 0 13 30 1 0 13 31 1 0 M END