Mol:FL3FALNI0016
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 36 38 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 0.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 0.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 0.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 1.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.8559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 1.8566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 0.6191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 -1.8559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -0.6184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2868 -0.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -1.8559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4278 1.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4278 2.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7145 3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.8545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8567 -2.2663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8567 -3.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -1.8545 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 5 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 8 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 FL3FALNI0016 KNApSAcK_ID C00013415 NAME Artelasticin;2-(2,4-Dihydroxyphenyl)-5,7-dihydroxy-3,6,8-tris(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 182052-13-7 FORMULA C30H34O6 EXACTMASS 490.23553882 AVERAGEMASS 490.58736000000005 SMILES C(C)(C)=CCc(c31)c(O)c(CC=C(C)C)c(O)c(C(=O)C(CC=C(C)C)=C(O3)c(c2)c(O)cc(c2)O)1 M END