Mol:FLID1CNI0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 32 0 0 0 0 0 0 0 0999 V2000 -2.0045 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0045 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8919 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 1.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 -0.0624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2207 0.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2207 0.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3356 1.2224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7768 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 -1.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9664 -0.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 0.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3339 -0.7488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5606 1.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0043 2.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0043 2.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5604 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4482 3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3716 -1.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9658 -2.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9658 -2.8064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3728 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5588 -3.1487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5606 -1.0921 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 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 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 1 0 0 0 0 12 17 1 0 0 0 0 1 18 1 0 0 0 0 6 19 1 0 0 0 0 19 20 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 13 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 14 29 1 0 0 0 0 S SKP 8 ID FLID1CNI0005 KNApSAcK_ID C00010016 NAME Erybraedin A;4-Prenylphaseollidin;(6aR,11aR)-3,9-Dihydroxy-4,10-diprenylpterocarpan CAS_RN 119269-76-0 FORMULA C25H28O4 EXACTMASS 392.19875938399997 AVERAGEMASS 392.48742 SMILES C(C)(C)=CCc(c(O)4)c(c(cc4)1)OCC(c23)C1Oc2c(c(cc3)O)CC=C(C)C M END