14728998 CDK 1202211636 33 36 0 0 0 0 0 0 0 0999 V2000 10.7831 1.5501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9171 0.8944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -0.7922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 0.8578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1173 -1.2333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 1.2703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 -1.2047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1078 1.2988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2671 0.8880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0921 0.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7882 0.2223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0066 0.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0035 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0890 1.7162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0953 0.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2937 0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 0.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 0.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5777 0.4652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2874 1.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9508 0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5745 1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8648 0.0499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3798 0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -0.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 1.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 0.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1173 0.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3798 -0.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9508 -0.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 -1.2047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8648 -0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 10 1 0 0 0 0 3 17 1 0 0 0 0 4 18 1 0 0 0 0 5 30 1 0 0 0 0 5 33 1 0 0 0 0 6 28 1 0 0 0 0 7 31 1 0 0 0 0 8 29 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 21 1 0 0 0 0 16 20 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 21 23 2 0 0 0 0 22 28 2 0 0 0 0 22 31 1 0 0 0 0 24 29 1 0 0 0 0 24 33 2 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 25 30 2 0 0 0 0 30 32 1 0 0 0 0 31 32 2 0 0 0 0 M END > CHEBI:185611 > Lupinisoflavone M > 2 > 6-(2,3-dihydroxy-3-methylbutyl)-5,7-dihydroxy-3-[2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzouran-5-yl]chromen-4-one > C25H28O8 > 456.491 > 456.17842 > 0 > O1C(C(O)(C)C)CC2=C1C=CC(=C2)C=3C(=O)C=4C(O)=C(CC(O)C(O)(C)C)C(O)=CC4OC3 > InChI=1S/C25H28O8/c1-24(2,30)19(27)9-14-16(26)10-18-21(22(14)28)23(29)15(11-32-18)12-5-6-17-13(7-12)8-20(33-17)25(3,4)31/h5-7,10-11,19-20,26-28,30-31H,8-9H2,1-4H3 > IXEGNYHOJYAEHW-UHFFFAOYSA-N > LMPK12050183 $$$$