Marvin 04291310342D 29 31 0 0 0 0 999 V2000 6.9970 -6.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0012 -7.1594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2806 -7.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5643 -7.1677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2723 -5.9100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7092 -5.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5601 -6.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8437 -7.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4256 -6.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1378 -5.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8437 -5.9224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1315 -7.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4256 -7.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1336 -5.0853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7050 -5.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1419 -7.5592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2848 -8.4006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1315 -6.3390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4172 -4.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1419 -8.3839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7175 -7.5717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8437 -8.4006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8541 -6.3223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4193 -5.9266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4089 -3.8525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8583 -8.7962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4297 -8.8004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7175 -8.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1211 -3.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 4 7 1 0 0 0 0 5 1 1 0 0 0 0 6 1 1 0 0 0 0 7 5 1 0 0 0 0 8 4 2 0 0 0 0 9 6 2 0 0 0 0 10 9 1 0 0 0 0 11 7 2 0 0 0 0 12 18 2 0 0 0 0 13 9 1 0 0 0 0 14 19 1 0 0 0 0 15 6 1 0 0 0 0 16 13 1 0 0 0 0 17 3 2 0 0 0 0 18 11 1 0 0 0 0 19 15 2 0 0 0 0 20 16 2 0 0 0 0 21 2 1 0 0 0 0 22 8 1 0 0 0 0 23 10 1 0 0 0 0 24 18 1 0 0 0 0 25 19 1 0 0 0 0 26 20 1 0 0 0 0 27 20 1 0 0 0 0 28 21 1 0 0 0 0 29 25 1 0 0 0 0 3 4 1 0 0 0 0 14 10 2 0 0 0 0 8 12 1 0 0 0 0 M END > CHEBI:70025 > 5,7,3'-trihydroxy-3,5'-dimethoxy-2'-(3'-methylbut-2-enyl)flavone > A trihydroxyflavone that is flavone substituted by hydroxy groups at positions 5, 7 and 3', methoxy groups at positions 3 and 5' and a prenyl group at position 2'. Isolated from Tabernaemontana macrocarpa, it exhibits inhibitory activity against breast cancer resistance protein. > 3 > 5,7-dihydroxy-2-[3-hydroxy-5-methoxy-2-(3-methylbut-2-en-1-yl)phenyl]-3-methoxy-4H-chromen-4-one > C22H22O7 > 398.40590 > 398.13655 > 0 > COc1cc(O)c(CC=C(C)C)c(c1)-c1oc2cc(O)cc(O)c2c(=O)c1OC > InChI=1S/C22H22O7/c1-11(2)5-6-14-15(9-13(27-3)10-16(14)24)21-22(28-4)20(26)19-17(25)7-12(23)8-18(19)29-21/h5,7-10,23-25H,6H2,1-4H3 > DFZUWIAIIXJYQQ-UHFFFAOYSA-N > 21312874 > 21275386 $$$$