Mol:FL3FGCGS0013
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 37 40 0 0 0 0 0 0 0 0999 V2000 0.7786 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0641 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0641 1.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7786 1.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4931 1.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4931 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6504 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3648 0.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0793 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0793 -0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3648 -1.1131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6504 -0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7938 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5082 0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5082 -0.7006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7938 -1.1131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3648 -1.8201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2227 0.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7938 -1.8536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1784 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7938 1.2335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1354 1.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -0.6854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8608 0.1685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3656 1.5636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1454 0.1602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7729 0.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4412 1.7103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7412 1.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5478 1.1008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1537 0.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8539 0.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0472 1.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8236 1.8536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 1.4959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8294 1.6981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 0.5653 0.0000 O 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 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 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 14 18 1 0 0 0 0 11 17 2 0 0 0 0 16 19 1 0 0 0 0 15 20 1 0 0 0 0 13 21 1 0 0 0 0 5 22 1 0 0 0 0 20 23 1 0 0 0 0 18 24 1 0 0 0 0 21 25 1 0 0 0 0 6 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 1 0 0 0 31 30 1 1 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 28 1 0 0 0 0 28 34 1 0 0 0 0 33 35 1 0 0 0 0 32 36 1 0 0 0 0 31 37 1 0 0 0 0 29 22 1 0 0 0 0 S SKP 8 ID FL3FGCGS0013 KNApSAcK_ID C00013995 NAME 5,4'-Dihydroxy-6,7,8,3'-tetramethoxyflavone 4'-galactoside CAS_RN - FORMULA C24H26O13 EXACTMASS 522.137340918 AVERAGEMASS 522.45544 SMILES O(C)c(c1)c(OC(C4O)OC(O)C(C4O)O)ccc(C(=C3)Oc(c2C(=O)3)c(OC)c(c(c2O)OC)OC)1 M END