Mol:EEL0020
Copyright: ARM project http://www.metabolome.jp/
53 52 0 0 0 0 0 0 0 0999 V2000 -9.0541 -0.8413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3396 -1.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3396 -2.0788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4233 -0.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3687 -0.6523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2144 -0.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6034 0.0824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9923 1.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3329 1.8653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4167 -0.0977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6061 0.8738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1931 1.6369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5588 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8445 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5845 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2989 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0134 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7277 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4423 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1568 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5855 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0144 2.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 1.6663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5825 -0.6720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9481 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4807 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1952 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9095 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6239 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3386 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0529 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7674 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4818 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1961 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9106 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6253 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3395 -0.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8445 0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0134 0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 0.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6239 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4818 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3395 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4434 2.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0541 -0.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3641 -1.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1341 -0.6653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3 2 2 0 4 2 1 0 1 2 1 0 6 7 1 0 7 8 1 0 8 9 1 0 7 11 1 0 7 10 1 0 12 9 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 24 23 1 0 25 24 1 0 26 25 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 39 38 1 0 40 39 1 0 41 40 1 0 10 27 1 0 14 42 1 0 18 43 1 0 22 44 1 0 26 45 1 0 29 46 1 0 33 47 1 0 37 48 1 0 41 49 1 0 26 50 1 0 41 51 1 0 5 52 1 0 4 5 1 0 6 53 1 0 5 53 1 0
A 5 Gal A 52 Glc S SKP 6 ID EEL0020 FORMULA C47H94O5 EXACTMASS 738.7101261180001 AVERAGEMASS 739.2462599999999 SMILES C(CCCC(CCCC(CCCC(C)CCOCC(COC(C)OC(C)=O)(OCCC(C)CCCC(CCCC(CCCC(C)C)C)C)[H])C)C)(C)C AUTODRAW FALSE M END
