Ketcher 06041513452D 1 1.00000 0.00000 0 43 47 0 1 0 999 V2000 22.9127 -13.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9167 -12.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7707 -13.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0627 -13.5180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7791 -11.5352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0627 -11.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6290 -13.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7667 -14.5138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2005 -13.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0627 -14.5095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.6331 -12.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2005 -12.0266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3423 -11.5309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3592 -12.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5052 -11.5393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3592 -13.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6387 -12.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5052 -13.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2174 -13.5223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6387 -13.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7805 -11.5393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5052 -14.5138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7805 -13.5223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.4987 -11.5410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4954 -10.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3537 -12.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3620 -10.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2118 -11.5559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.2160 -10.5645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3661 -9.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.0784 -10.0688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.9322 -10.5687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9140 -12.0405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1355 -12.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1355 -13.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0008 -14.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8610 -13.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8610 -12.6466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0008 -12.1483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2727 -12.1479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2727 -14.1421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0021 -15.1383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7245 -14.1410 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17 20 1 0 0 0 17 21 1 1 0 0 18 22 1 1 0 0 20 23 1 6 0 0 7 11 2 0 0 0 9 12 1 0 0 0 18 20 1 0 0 0 11 24 1 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 2 0 0 0 4 9 2 0 0 0 24 25 1 0 0 0 24 26 2 0 0 0 25 27 2 0 0 0 26 28 1 0 0 0 27 29 1 0 0 0 27 30 1 0 0 0 29 31 1 0 0 0 31 32 1 0 0 0 28 29 2 0 0 0 21 33 1 0 0 0 4 10 1 0 0 0 5 11 1 0 0 0 6 12 2 0 0 0 12 13 1 0 0 0 14 13 1 1 0 0 14 15 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 34 1 0 0 0 38 33 1 1 0 0 14 16 1 0 0 0 34 40 1 6 0 0 15 17 1 0 0 0 35 41 1 1 0 0 16 18 1 0 0 0 36 42 1 6 0 0 16 19 1 6 0 0 37 43 1 6 0 0 M END > CHEBI:4631 > diosmin > A disaccharide derivative that consists of diosmetin substituted by a 6-O-(α-L-rhamnopyranosyl)-β-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. > 3 > neodiosmin; Diosmetin 7-O-rutinoside; diosmetin 7-neohesperidoside; 3',5,7-trihydroxy-4'-methoxyflavone-7-rutinoside; 3',5,7-trihydroxy-4'-methoxyflavone 7-rhamnoglucoside > 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside > diosminum; diosmine; diosmin > C28H32O15 > 608.54470 > 608.17412 > 0 > COc1ccc(cc1O)-c1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](CO[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@H]3O)cc2o1 > InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1 > GZSOSUNBTXMUFQ-YFAPSIMESA-N > 520-27-4 > 74883 > 520-27-4 > C10039 > D07858 > C00004362 > LSM-5989 > LMPK12110819 > Diosmin > 25620156; 25821971 $$$$