HMDB0302417 RDKit 3D Hex-trans-2-enyl acetate 24 23 0 0 0 0 0 0 0 0999 V2000 1.9584 1.3030 0.4282 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8904 0.1169 0.2335 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0544 -1.1761 0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -1.0261 -0.9351 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1632 -1.0408 -0.8046 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8811 -1.2023 0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7228 -0.0619 0.7213 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7412 0.2875 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6278 1.4802 0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9224 -0.4145 -1.1613 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4228 1.5412 -0.4934 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1938 1.0251 1.1966 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4962 2.1864 0.7719 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5805 0.0711 1.0728 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3499 0.2043 -0.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6518 -1.4146 1.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8323 -1.9798 -0.0245 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5901 -0.8938 -1.9586 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7471 -0.9212 -1.7313 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1997 -1.3153 1.2911 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6121 -2.0591 0.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5593 1.3140 -0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1437 2.3828 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8258 1.5932 1.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 0 1 11 1 0 1 12 1 0 1 13 1 0 2 14 1 0 2 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 5 19 1 0 6 20 1 0 6 21 1 0 9 22 1 0 9 23 1 0 9 24 1 0 M END