Mol:FL4DCDNI0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/ 29 31 0 0 0 0 0 0 0 0999 V2000 -1.7802 0.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0667 0.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7753 -0.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0575 -1.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3468 -0.6233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3504 0.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3714 -1.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0831 -0.6154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0776 0.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3622 0.6174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7921 0.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5074 0.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 0.6308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 1.4558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5008 1.8639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 1.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3714 -1.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0575 -1.8639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4947 0.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7976 -1.0279 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3607 -0.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8739 1.8356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1021 0.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0866 -0.5501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -0.9539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -1.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4882 -0.5485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8608 0.2614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4882 0.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 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 2 1 0 0 0 0 5 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 6 1 0 0 0 0 9 11 1 6 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 2 0 0 0 0 4 18 1 0 0 0 0 8 20 1 1 0 0 0 1 19 1 0 0 0 0 3 21 1 0 0 0 0 14 22 1 0 0 0 0 19 23 1 0 0 0 0 21 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 13 28 1 0 0 0 0 28 29 1 0 0 0 0 S SKP 8 ID FL4DCDNI0002 KNApSAcK_ID C00014381 NAME (2R,3R)-3,5,4'-Trihydroxy-7,3'-dimethoxy-6-prenylflavanone CAS_RN 213910-83-9 FORMULA C22H24O7 EXACTMASS 400.152203122 AVERAGEMASS 400.42176000000006 SMILES O(C)c(c3CC=C(C)C)cc(c2c3O)OC(C(C(=O)2)O)c(c1)ccc(c(OC)1)O M END