Mol:EEL3003
Copyright: ARM project http://www.metabolome.jp/
57 56 0 0 0 0 0 0 0 0999 V2000 -7.3124 -2.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7816 -1.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3627 -0.6275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8318 0.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4128 0.9152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5767 -1.0479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6059 -0.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3533 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6387 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9244 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4955 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7812 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0667 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3523 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6377 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0767 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5054 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2199 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9343 0.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6488 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7425 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3136 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5993 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1705 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4561 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7415 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0271 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6874 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4017 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1161 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8305 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5451 -0.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2594 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9244 2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0667 2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6488 2.1701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3136 0.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4561 0.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4017 0.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2594 0.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3632 0.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9739 -0.9931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0777 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7922 0.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2211 0.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 2.1526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6884 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4029 -0.9931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1174 -0.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8318 -0.9931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1174 0.2444 0.0000 C 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 3 7 1 0 3 6 1 0 8 5 1 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 22 21 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 37 36 1 0 6 23 1 0 10 38 1 0 14 39 1 0 18 40 1 0 22 41 1 0 25 42 1 0 29 43 1 0 33 44 1 0 37 45 1 0 22 46 1 0 37 47 1 0 46 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 47 53 1 0 53 54 1 0 54 55 1 0 55 56 1 0 55 57 1 0
S SKP 6 AUTODRAW FALSE ID EEL3003 FORMULA C53H108O3 EXACTMASS 792.829847322 AVERAGEMASS 793.42282 SMILES C(CC(CCOCC(OCCC(C)CCCC(CCCC(C)CCCC(CCCC(C)C)C)C)([H])CO)C)CC(C)CCCC(CCCC(CCCC(C)C)C)C M END
