Mol:FL5FAANI0009
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 31 33 0 0 0 0 0 0 0 0999 V2000 -2.8741 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8741 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7615 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7615 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2052 -1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6489 -0.9633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6489 -0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2052 0.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2052 -1.7853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0928 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4742 -0.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 0.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4742 0.9821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0928 0.6548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0691 -1.2697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 -1.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 0.9821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4302 0.0001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 0.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7405 -0.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3049 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8681 -0.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4302 -0.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8681 -1.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 0.9634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8739 1.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 1.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3178 1.9266 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 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 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 17 2 0 0 0 0 17 12 1 0 0 0 0 8 18 1 0 0 0 0 3 19 1 0 0 0 0 15 20 1 0 0 0 0 1 21 1 0 0 0 0 6 22 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 23 14 1 0 0 0 0 22 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 FL5FAANI0009 KNApSAcK_ID C00005029 NAME Broussoflavonol F;3,5,7-Trihydroxy-2-[4-hydroxy-3-(3-methyl-2-butenyl)phenyl]-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one CAS_RN 162558-94-3 FORMULA C25H26O6 EXACTMASS 422.172938564 AVERAGEMASS 422.47033999999996 SMILES c(c3)(O)c(c(c(c3O)1)OC(c(c2)cc(CC=C(C)C)c(c2)O)=C(O)C1=O)CC=C(C)C M END