Mol:FL1DACNI0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 32 0 0 0 0 0 0 0 0999 V2000 -2.4648 -0.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4648 -1.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7504 -1.6142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -1.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -0.3767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7504 0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3616 -1.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3434 -1.1840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3434 -0.3436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0615 0.0710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7759 -0.3415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4904 0.0710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4904 0.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7759 1.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0615 0.8960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3616 -2.2422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1194 1.2591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7504 -2.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -0.0100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -0.0333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7759 1.9521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7504 0.7785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 1.2176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 1.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9035 2.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1301 2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1301 -0.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1301 -1.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 -1.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5543 -2.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9282 -1.0083 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 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 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 10 1 0 0 0 0 7 16 2 0 0 0 0 13 17 1 0 0 0 0 3 18 1 0 0 0 0 1 19 1 0 0 0 0 5 20 1 0 0 0 0 14 21 1 0 0 0 0 6 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 12 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 FL1DACNI0001 KNApSAcK_ID C00014619 NAME 2',4',6',3,4-Pentahydroxy- 3',5-diprenyldihydrochalcone CAS_RN 205109-20-2 FORMULA C25H30O6 EXACTMASS 426.204238692 AVERAGEMASS 426.5021 SMILES Oc(c2CC=C(C)C)c(c(O)cc2O)C(CCc(c1)cc(c(O)c1CC=C(C)C)O)=O M END