Mol:LBF20307HP02
Copyright: ARM project http://www.metabolome.jp/
29 29 0 0 0 0 0 0 0 0999 V2000 6.9011 -0.1938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1866 0.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4721 -0.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7602 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0483 -0.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3363 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6243 -0.1938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9485 0.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2897 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5583 -0.9971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3831 -0.9828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6156 0.2186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5752 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1866 1.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3363 1.0421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0508 1.4546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2498 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9643 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7893 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5038 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3288 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0432 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0432 -1.0421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3288 -1.4546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7577 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4722 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1866 0.1954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9011 -0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6156 0.1954 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 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 7 1 0 1 12 1 0 9 13 1 0 2 14 2 0 6 15 1 0 15 16 1 0 13 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 22 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0
S SKP 6 ID LBF20107HP01 FORMULA C21H34O8 EXACTMASS 414.225368064 AVERAGEMASS 414.48986 SMILES C(CCC(OO)C=CC=CC=CC(C1)OOC1C(OO)CCCC(OC)=O)CC AUTODRAW FALSE M END
