Mol:LBF20408LX01
Copyright: ARM project http://www.metabolome.jp/
25 24 0 0 0 0 0 0 0 0999 V2000 0.3475 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0621 0.8237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7766 0.4111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0621 1.6486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3672 0.8237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0816 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7936 0.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5056 0.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2176 0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 0.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9296 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2151 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7862 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0717 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0717 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5006 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -0.4140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9296 -0.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 0.0525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7937 1.6443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3572 -1.6486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 0 1 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 17 23 1 1 7 24 1 1 16 25 1 6
S SKP 6 ID LBF20408LX01 FORMULA C20H32O5 EXACTMASS 352.224974134 AVERAGEMASS 352.46508 SMILES C(CCC(O)C(O)C=CC=CC=CC=CC(CCCC(O)=O)O)CC AUTODRAW FALSE M END
