Mol:FL3FALNI0014
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 36 38 0 0 0 0 0 0 0 0999 V2000 -1.7850 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4995 1.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2139 0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2139 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4995 -0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 -0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 1.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 1.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 1.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 2.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0705 -1.2354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5018 2.4771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9284 1.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4995 -1.2354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 0.0021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 -0.4104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3584 -1.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 -1.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0729 -2.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 -1.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4995 2.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2127 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2127 3.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9248 3.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5006 3.7084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7874 -2.8854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5018 -2.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9284 -2.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2151 -3.7084 0.0000 C 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 1 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 2 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 7 17 2 0 0 0 0 18 14 1 0 0 0 0 4 19 1 0 0 0 0 6 20 1 0 0 0 0 12 21 1 0 0 0 0 8 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 3 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 S SKP 8 ID FL3FALNI0014 KNApSAcK_ID C00013413 NAME Artocommunol CD;2-(2,4-Dihydroxyphenyl)-3-[(2E)-3,7-dimethyl-2,6-octadienyl]-5,7-dihydroxy-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 502627-56-7 FORMULA C30H34O6 EXACTMASS 490.23553882 AVERAGEMASS 490.58736000000005 SMILES c(c(O)3)c(c(c1c(CC=C(C)C)3)C(=O)C(=C(c(c2)c(cc(c2)O)O)O1)CC=C(C)CCC=C(C)C)O M END
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