Mol:FL2FALNP0016
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 36 39 0 0 0 0 0 0 0 0999 V2000 -1.6378 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6378 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0752 -1.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4457 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4457 -0.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0752 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9661 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0752 -1.7262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5004 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0348 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0348 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5004 0.9258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9661 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1587 0.0006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -1.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5691 0.9258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 0.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6373 0.9019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1582 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6786 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5691 -0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1035 0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1035 0.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4616 1.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 0.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6373 1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1577 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 1.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1978 -1.2014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -0.9016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1978 -1.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4253 0.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 3 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 4 1 0 0 0 0 9 11 1 0 0 0 0 7 12 2 0 0 0 0 11 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 11 1 0 0 0 0 6 18 1 0 0 0 0 2 19 1 0 0 0 0 20 15 1 0 0 0 0 5 21 1 0 0 0 0 21 22 1 0 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 14 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 20 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 22 30 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 24 33 2 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 17 36 1 0 0 0 0 S SKP 8 ID FL2FALNP0016 KNApSAcK_ID C00008474 NAME Euchrenone a6 CAS_RN 125140-21-8 FORMULA C30H34O6 EXACTMASS 490.23553882 AVERAGEMASS 490.58736000000005 SMILES Oc(c(CC=C(C)C)1)c(CC=C(C)C)c(O2)c(C(CC2c(c4)c(O)cc(c43)OC(C=C3)(C)C)=O)c1O M END
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