HMDB0034458 RDKit 3D Isobutyl enanthate 35 34 0 0 0 0 0 0 0 0999 V2000 -5.6914 1.0032 0.2935 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3708 0.3604 -0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0147 -0.8074 0.6967 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7266 -1.4350 0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6182 -0.4311 0.3274 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3061 -1.0878 -0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7643 -0.0310 -0.0207 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5051 1.1307 0.3822 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0767 -0.3114 -0.3643 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0448 0.7089 -0.2462 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3687 0.1036 -0.6905 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7468 -1.0640 0.1645 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3938 1.2226 -0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3879 0.1431 0.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0680 1.6758 -0.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5286 1.5836 1.2244 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5932 1.1552 -0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4519 0.0858 -1.2069 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9019 -0.5057 1.7727 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8318 -1.5671 0.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4411 -2.3098 0.8566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -1.7170 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4456 -0.0960 1.3649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7482 0.4368 -0.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4679 -1.3685 -1.1837 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0817 -1.9587 0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 1.5655 -0.8738 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1458 1.0858 0.7847 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3354 -0.2235 -1.7432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8329 -1.2518 0.2112 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3781 -0.9182 1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2633 -1.9973 -0.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1825 1.8881 -1.4943 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2738 1.8467 0.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4242 0.8249 -0.7512 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 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 4 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 12 30 1 0 12 31 1 0 12 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 M END