Mol:EEL0034
Copyright: ARM project http://www.metabolome.jp/
53 52 0 0 0 0 0 0 0 0999 V2000 -7.0527 -0.9889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9953 -0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4743 -0.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8632 -0.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2522 0.7886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5928 1.5744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6767 -0.3887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8661 0.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4532 1.3459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8186 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1045 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3244 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0387 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7533 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4676 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1822 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8965 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3253 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0398 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7541 1.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4686 1.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8423 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2081 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5064 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2206 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6495 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3638 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0784 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7927 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5074 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2216 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6503 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3649 -0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0793 -0.9455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1045 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7533 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4686 0.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5064 -1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3638 -1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2216 -1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0793 -1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1831 1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7938 -0.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5830 -0.9785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3792 -0.9889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7806 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3740 -0.9947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7938 -0.2838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 4 1 0 4 5 1 0 5 6 1 0 4 8 1 0 4 7 1 0 9 6 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 23 22 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 38 37 1 0 7 24 1 0 11 39 1 0 15 40 1 0 19 41 1 0 23 42 1 0 26 43 1 0 30 44 1 0 34 45 1 0 38 46 1 0 23 47 1 0 38 48 1 0 1 2 1 0 49 3 1 0 49 2 1 0 50 1 1 0 51 52 1 0 52 53 2 0 50 52 1 0
A 1 Glc A 2 Glc S SKP 6 ID EEL0034 FORMULA C47H94O5 EXACTMASS 738.7101261180001 AVERAGEMASS 739.2462599999999 SMILES C(CCCC(CCCC(CCCC(CCOCC(COCCOC(C)=O)([H])OCCC(CCCC(C)CCCC(CCCC(C)C)C)C)C)C)C)(C)C AUTODRAW FALSE M END
