Mol:LBF20203PG01
Copyright: ARM project http://www.metabolome.jp/
25 25 0 0 0 0 0 0 0 0999 V2000 2.0086 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7233 0.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4377 0.4104 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7233 1.6478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 0.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5795 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 0.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8494 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5614 0.8214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 0.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -0.6696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 -0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5589 -0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8445 -0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1325 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5795 -0.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2915 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1165 -0.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -0.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -0.8243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3121 1.4472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3121 -1.4515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1325 -1.6478 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 1 0 10 9 1 6 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 10 1 0 14 15 1 1 15 16 2 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 1 0 11 23 2 0 13 24 1 6 17 25 1 6
S SKP 6 ID LBF20203PG01 FORMULA C20H32O5 EXACTMASS 352.224974134 AVERAGEMASS 352.46508 SMILES C(=CC[C@@H](O)C=C[C@H]([C@H]1CCCCCCC(O)=O)[C@@H](CC1=O)O)CC AUTODRAW FALSE M END
