LMPK12112259 LIPID_MAPS_STRUCTURE_DATABASE 57 62 0 0 0 0 0 0 0 0999 V2000 6.9573 7.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9573 6.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8746 6.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7917 6.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7917 7.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8746 8.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 6.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6263 6.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6263 7.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 8.5257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7090 5.5815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5431 8.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4777 7.9856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4127 8.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4127 9.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4777 10.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5431 9.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0405 8.5254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3472 10.1445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2758 6.2956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8746 5.3486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4777 11.2238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3769 6.1853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9055 7.0022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2426 6.1853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6170 6.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3651 6.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8148 6.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7143 6.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1642 6.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7143 7.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8148 7.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0619 6.8337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7948 4.9095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4299 2.9219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5295 2.2481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1217 4.8867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9892 2.5478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0754 5.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8447 4.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6604 3.5766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7104 3.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 3.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9907 3.5580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6986 5.5873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2375 4.2773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8710 2.2947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3820 3.2607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8411 1.1105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5633 4.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5153 4.5961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2858 3.9383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1024 2.9471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1506 2.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9672 1.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2106 5.1951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7142 4.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 7 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 12 1 0 0 0 0 1 18 1 0 0 0 0 15 19 1 0 0 0 0 8 20 1 0 0 0 0 3 21 1 0 0 0 0 16 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 27 1 0 0 0 0 30 33 1 0 0 0 0 38 44 1 0 0 0 43 37 1 0 0 0 37 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 1 0 0 40 34 1 6 0 0 41 35 1 1 0 0 42 36 1 6 0 0 49 55 1 0 0 0 54 48 1 0 0 0 48 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 1 0 0 50 34 1 1 0 0 51 45 1 6 0 0 52 46 1 1 0 0 53 47 1 6 0 0 39 20 1 1 0 0 23 45 1 0 0 0 0 29 56 1 0 0 0 56 57 1 0 0 0 M END > LMPK12112259 > Quercetin 3-(2'''-feruloylsophoroside) > 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-[[2-O-[2-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one > C37H38O20 > 802.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > BYEFUYPJCOTACA-TXWHVLLVSA-N > InChI=1S/C37H38O20/c1-51-21-8-14(2-5-18(21)42)3-7-25(45)55-34-30(49)27(46)23(12-38)53-36(34)57-35-31(50)28(47)24(13-39)54-37(35)56-33-29(48)26-20(44)10-16(40)11-22(26)52-32(33)15-4-6-17(41)19(43)9-15/h2-11,23-24,27-28,30-31,34-44,46-47,49-50H,12-13H2,1H3/b7-3+/t23-,24-,27-,28-,30+,31+,34-,35-,36+,37+/m1/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](OC(/C=C/C5C=CC(O)=C(OC)C=5)=O)[C@@H](O)[C@H](O)[C@@H](CO)O4)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 12313456 > - > - > - > - > - > 33090; 4101 > - $$$$