Mol:LBF20406CV02
Copyright: ARM project http://www.metabolome.jp/
27 28 0 0 0 0 0 0 0 0999 V2000 -1.5678 -0.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3084 -0.7437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3084 -1.5687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -1.8236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -1.1562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -0.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5678 0.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8558 0.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8558 1.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5239 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8095 -1.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 -1.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5219 -2.3656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9386 -2.9489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1521 -3.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1417 -2.7354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3479 0.2960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1413 2.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3129 2.9451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1333 3.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4689 2.2777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5458 3.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 2 1 0 1 7 1 0 7 8 2 0 8 9 1 0 10 11 1 0 11 12 2 0 12 13 1 0 3 10 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 3 18 1 1 18 19 1 0 19 20 1 0 19 21 2 0 6 22 2 0 9 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 9 26 1 6 25 27 2 0
S SKP 6 ID LBF20406CV02 FORMULA C22H28O5 EXACTMASS 372.193674006 AVERAGEMASS 372.45472000000007 SMILES CC(=O)O[C@@](CC=CCCCCC)(C=2)C(C(C2)=O)=CC=C[C@H](O1)CCC(=O)1 AUTODRAW FALSE M END
