Mol:FL3FRNND0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 37 42 0 0 0 0 0 0 0 0999 V2000 -2.2184 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2184 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9329 0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9329 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5039 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7895 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7895 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5039 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5039 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6473 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6473 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9329 -1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6395 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6395 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6395 1.8563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9241 0.2896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9266 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9266 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7513 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7894 1.8563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9454 1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3618 0.6187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0763 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0763 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3618 -1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 0.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6008 -0.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -0.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -0.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9137 -0.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6008 -0.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9137 0.5513 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 11 2 0 0 0 0 10 4 2 0 0 0 0 4 1 1 0 0 0 0 1 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 2 1 0 0 0 0 5 9 2 0 0 0 0 11 10 1 0 0 0 0 4 12 1 0 0 0 0 6 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 7 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 16 1 0 0 0 0 20 25 1 0 0 0 0 17 21 1 0 0 0 0 14 22 1 0 0 0 0 22 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 18 26 1 0 0 0 0 11 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 10 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 24 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 S SKP 8 ID FL3FRNND0002 KNApSAcK_ID C00013486 NAME Artonin M; 5a,6-Dihydro-1,3,8-trihydroxy-5,11,11-trimethyl-5-(4-methyl-3-pentenyl)-5H,7H,11H-benzofuro[3,4-bc]pyrano[2,3-i]xanthen-7-one CAS_RN 151627-66-6 FORMULA C30H30O7 EXACTMASS 502.199153314 AVERAGEMASS 502.55500000000006 SMILES C(C)(C)=CCCC(C56)(Oc(c16)c(O)cc(c1C(O2)=C(C5)C(c(c(O)3)c2cc(O4)c3C=CC4(C)C)=O)O)C M END