Ketcher 06051514482D 1 1.00000 0.00000 0 29 31 0 0 0 999 V2000 18.4844 -21.5570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4886 -20.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6205 -22.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3525 -22.0620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6205 -20.0506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3608 -20.0547 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7526 -21.5570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5746 -23.0636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2246 -21.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3482 -23.0677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7526 -20.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5746 -19.0491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.2287 -20.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8846 -22.0578 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7568 -23.5642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8846 -20.0506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7526 -18.5442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1009 -20.0631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0166 -21.5570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0209 -20.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1009 -19.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9647 -20.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9731 -18.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8327 -20.0714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8369 -19.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9772 -17.5593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.7090 -18.5693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8452 -17.0627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5729 -19.0699 0.0000 C 0 0 0 0 0 0 0 0 0 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 2 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 4 10 2 0 0 0 5 11 2 0 0 0 5 12 1 0 0 0 6 13 1 0 0 0 7 14 1 0 0 0 8 15 1 0 0 0 11 16 1 0 0 0 12 17 1 0 0 0 13 18 1 0 0 0 14 19 1 0 0 0 16 20 1 0 0 0 18 21 1 0 0 0 18 22 2 0 0 0 21 23 2 0 0 0 22 24 1 0 0 0 23 25 1 0 0 0 23 26 1 0 0 0 25 27 1 0 0 0 26 28 1 0 0 0 27 29 1 0 0 0 7 11 1 0 0 0 9 13 2 0 0 0 24 25 2 0 0 0 M END > CHEBI:7602 > nobiletin > A methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3' and 4' respectively. > 3 > Hexamethoxyflavone; 5,6,7,8,3',4'-Hexamethoxyflavone > 2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one > C21H22O8 > 402.39460 > 402.13147 > 0 > COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 > InChI=1S/C21H22O8/c1-23-13-8-7-11(9-15(13)24-2)14-10-12(22)16-17(25-3)19(26-4)21(28-6)20(27-5)18(16)29-14/h7-10H,1-6H3 > MRIAQLRQZPPODS-UHFFFAOYSA-N > 478-01-3 > 360887 > 478-01-3 > C10112 > C00001076 > LSM-2130 > LMPK12111468 > 478-01-3 > Nobiletin > 25488359; 25845666 $$$$