Mol:LBF20406CV13
Copyright: ARM project http://www.metabolome.jp/
26 26 0 0 0 0 0 0 0 0999 V2000 -0.0269 0.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7414 0.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4535 0.6032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1655 0.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9501 0.4471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -0.2203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9501 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1655 -0.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -1.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7364 -0.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0886 -0.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8031 -1.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5176 -0.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 -1.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9416 -0.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6536 -1.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2051 1.2318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -1.4297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6876 0.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4021 0.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1165 0.1922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 0.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 1.4297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5455 0.1922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 0.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 -0.2202 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 4 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 5 17 2 0 8 18 1 6 1 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 24 25 1 0 6 26 1 0
S SKP 6 ID LBF20406CV13 FORMULA C21H29ClO4 EXACTMASS 380.175437126 AVERAGEMASS 380.90525999999994 SMILES C(C(=O)1)(Cl)=C[C@](CC=CCCCCC)(C(=CC=CCCCC(OC)=O)1)O AUTODRAW FALSE M END
