Mol:FL2FALNP0021
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 31 34 0 0 0 0 0 0 0 0999 V2000 -3.1604 -0.9516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1419 -1.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3647 -2.1406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7099 -1.7395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6957 -0.9146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4214 -0.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9549 -2.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2811 -1.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2904 -0.8977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9742 -0.5145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4241 -0.4852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1152 -0.8717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8226 -0.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8515 0.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1353 0.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4149 0.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9549 -2.9067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9441 -0.5301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3647 -2.9890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5213 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2489 -0.5300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2779 0.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5792 0.7303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6052 0.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1152 -1.5861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1353 1.5178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4732 1.9001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4732 2.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0603 2.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1097 2.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 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 5 1 0 0 0 0 9 11 1 6 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 1 1 0 0 0 0 3 19 1 0 0 0 0 13 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 14 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 12 26 1 0 0 0 0 15 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 S SKP 8 ID FL2FALNP0021 KNApSAcK_ID C00014246 NAME Sanggenol N;(2S)-5,7,2'-Trihydroxy-5'-prenyl-6'',6''-dimethylpyrano[2'',3'':4',3']flavanone CAS_RN 426211-26-9 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES CC(C)=CCc(c2)c(c(c(c2C(C3)Oc(c4)c(c(cc4O)O)C3=O)O)1)OC(C=C1)(C)C M END
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