Mol:FL1CA9NI0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 30 0 0 0 0 0 0 0 0999 V2000 3.3239 0.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3239 -0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8802 -0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4365 -0.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4365 0.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8802 0.9389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1907 -0.0040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -0.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6346 -0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0737 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6346 -0.9658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0737 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0316 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0316 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.9485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1369 0.0086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5842 -0.3105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6894 -0.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6894 -0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2407 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7909 -0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3398 0.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8888 -0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8888 -0.9422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4365 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5841 0.9657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6262 0.9657 0.0000 O 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 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 2 8 1 0 0 0 0 10 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 10 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 15 1 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 14 28 1 0 0 0 0 12 29 1 0 0 0 0 S SKP 8 ID FL1CA9NI0007 KNApSAcK_ID C00007128 NAME 3'-Geranyl-2',4',6'-trihydroxychalcone CAS_RN 73436-02-9 FORMULA C25H28O4 EXACTMASS 392.19875938399997 AVERAGEMASS 392.48742 SMILES Oc(c1)c(C(C=Cc(c2)cccc2)=O)c(O)c(CC=C(C)CCC=C(C)C)c(O)1 M END