Mol:FL2FA9NR0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -0.2178 -0.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 0.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 0.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2178 0.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 -0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8657 -0.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8657 0.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 0.4641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3861 0.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 -1.2628 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9205 0.1553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4548 0.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4548 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9205 1.3893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3861 1.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3031 -1.2032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 0.4638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7382 -0.7385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2585 -0.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 -0.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3569 -0.4381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3569 -1.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 -1.3893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2585 -1.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8077 0.5128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9059 -0.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9059 -1.3892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4548 -1.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8029 -1.3353 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 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 S SKP 8 ID FL2FA9NR0003 KNApSAcK_ID C00008405 NAME Lepidissipyrone CAS_RN 122585-68-6 FORMULA C24H22O7 EXACTMASS 422.136553058 AVERAGEMASS 422.42728 SMILES c(c3O)(C2=O)c(cc(O)c3CC(=C4O)C(OC(CC)=C4C)=O)OC(C2)c(c1)cccc1 M END