ChEBI 32 35 0 0 1 0 0 0 0 0 1 V2000 17.2763 -16.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2763 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1245 -15.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1245 -18.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9727 -16.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9727 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5798 -16.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5798 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4280 -15.7388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4280 -18.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6691 -16.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6691 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5173 -15.7388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5173 -18.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3655 -16.4038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3655 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8209 -15.7388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8209 -18.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5173 -19.7287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2138 -18.3988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2137 -15.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 -16.4038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1245 -19.7287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4280 -19.7287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.0352 -18.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0352 -19.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8834 -17.7338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8834 -20.3937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7316 -18.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7316 -19.7287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1553 -20.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.3333 -19.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 1 2 0 0 0 0 4 2 2 0 0 0 0 5 3 1 0 0 0 0 6 4 1 0 0 0 0 6 5 2 0 0 0 0 8 7 2 0 0 0 0 9 7 1 0 0 0 0 10 8 1 0 0 0 0 1 9 1 0 0 0 0 2 10 1 0 0 0 0 2 1 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 16 1 0 0 0 0 11 17 1 1 0 0 0 12 18 1 6 0 0 0 14 19 1 1 0 0 0 16 20 1 6 0 0 0 15 21 1 1 0 0 0 22 21 1 0 0 0 0 5 17 1 0 0 0 0 23 4 1 0 0 0 0 24 10 2 0 0 0 0 26 25 1 0 0 0 0 27 25 2 0 0 0 0 28 26 2 0 0 0 0 29 27 1 0 0 0 0 30 28 1 0 0 0 0 30 29 2 0 0 0 0 8 29 1 0 0 0 0 31 26 1 0 0 0 0 32 31 1 0 0 0 0 M END > CHEBI:28751 > biochanin A 7-O-beta-D-glucoside > A glycosyloxyisoflavone that is biochanin A attached to a β-D-glucopyranosyl residue at position 7 via glycosidic linkage. > 3 > CHEBI:3106; CHEBI:22877 > Sissotrin; sissotrin; Biochanin A-beta-D-glucoside; Biochanin A 7-O-beta-D-glucoside; biochanin A 7-O-beta-D-glucoside > 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside > C22H22O10 > 446.40408 > 446.12130 > 0 > COc1ccc(cc1)-c1coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c2c1=O > InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3/t16-,19-,20+,21-,22-/m1/s1 > LFEUICHQZGNOHD-RECXWPGBSA-N > 5928-26-7 > 1302649 > C05376 > IND44720943 > 16650770; 22926873; 23030687; 23397722 $$$$