Mol:FLID1ANI0006
From Metabolomics.JP
<pre> Copyright: ARM project http://www.metabolome.jp/ 29 32 0 0 0 0 0 0 0 0999 V2000 -2.0044 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0044 0.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4481 0.2857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8918 0.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8918 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4481 1.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3355 0.2857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 0.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3355 1.5704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7769 0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7769 -0.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3717 -0.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9665 -0.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9665 0.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3717 0.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3296 -0.4008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5607 1.5704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5607 -0.7440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9932 1.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5874 2.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1816 1.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5874 2.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9862 1.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3717 -1.4305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9647 -1.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9647 -2.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3729 -2.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5565 -2.7979 0.0000 C 0 0 0 0 0 0 0 0 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 8 11 1 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 16 1 0 0 0 0 16 11 2 0 0 0 0 7 17 1 0 0 0 0 1 2 1 0 0 0 0 12 17 1 0 0 0 0 1 18 1 0 0 0 0 14 19 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 8 24 1 0 0 0 0 24 20 1 0 0 0 0 13 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 S SKP 8 ID FLID1ANI0006 KNApSAcK_ID C00009666 NAME Lespein;3,9-Dihydroxy-6a,10-diprenylpterocarpan CAS_RN 51447-95-1 FORMULA C25H28O4 EXACTMASS 392.19875938399997 AVERAGEMASS 392.48742 SMILES C(C(c43)(C2)C(Oc3c(c(cc4)O)CC=C(C)C)c(c1O2)ccc(c1)O)C=C(C)C M END
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