HMDB0033377 RDKit 3D cis-3-Hexenyl butyrate 30 29 0 0 0 0 0 0 0 0999 V2000 -4.6790 1.1491 -1.4469 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6622 0.0062 -1.3017 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6143 -0.3798 0.1197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5482 -0.3263 0.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2486 0.1469 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2508 -0.9883 0.5509 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0059 -0.5699 0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -1.3245 0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.4778 0.5796 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4248 -0.7481 -0.4758 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7995 0.4186 0.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0482 1.1199 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4532 1.7753 -2.3293 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6645 1.7323 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6786 0.6859 -1.4811 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7253 0.2314 -1.7724 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1027 -0.8462 -1.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -0.7519 0.5997 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6484 -0.6481 1.9643 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9202 1.0293 1.0082 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2394 0.4811 -0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1342 -1.1493 1.6416 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6089 -1.8783 0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1898 -1.5337 -0.4669 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1955 -0.3758 -1.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8006 0.0702 1.5033 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9303 1.1399 0.3533 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7562 1.1257 0.8771 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8331 2.2039 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4888 0.6825 -0.8949 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 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 4 19 1 0 5 20 1 0 5 21 1 0 6 22 1 0 6 23 1 0 10 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 12 28 1 0 12 29 1 0 12 30 1 0 M END