Mol:FL2FA9NR0004
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 36 39 0 0 0 0 0 0 0 0999 V2000 -0.2178 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2178 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 -1.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8657 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8657 -0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 0.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3861 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 -1.7014 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9205 -0.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4548 0.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4548 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9205 0.9506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3861 0.6421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 -1.6419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 0.0251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 -1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2585 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 -0.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3569 -0.8768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3569 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 -1.8280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2585 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 0.0741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9059 -0.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9059 -1.8279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4548 -1.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8029 -1.7740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 0.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2173 0.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2173 1.5276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7377 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 1.8280 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 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 2 18 1 0 0 0 0 6 19 1 0 0 0 0 1 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 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 25 26 1 0 0 0 0 26 21 1 0 0 0 0 22 27 1 0 0 0 0 23 28 1 0 0 0 0 24 29 1 0 0 0 0 29 30 1 0 0 0 0 26 31 2 0 0 0 0 5 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 FL2FA9NR0004 KNApSAcK_ID C00008406 NAME 8-Prenyllepidissipyrone CAS_RN 122616-68-6 FORMULA C29H30O7 EXACTMASS 490.199153314 AVERAGEMASS 490.5443 SMILES CC(C)=CCc(c21)c(c(CC(=C4O)C(=O)OC(CC)=C4C)c(O)c1C(=O)CC(c(c3)cccc3)O2)O M END