LMPK12112135 LIPID_MAPS_STRUCTURE_DATABASE 55 60 0 0 0 999 V2000 9.2641 9.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2641 7.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1975 7.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1310 7.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1310 9.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1975 9.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0644 7.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9979 7.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9979 9.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0644 9.5936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0644 6.5977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1733 9.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1245 9.2518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0759 9.8012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0759 10.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1245 11.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1733 10.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1975 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8786 11.3798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9431 7.2899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5145 9.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0269 9.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8915 13.1060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8932 13.0917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8773 11.3540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3738 10.5024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8498 9.7999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8771 11.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3835 12.2371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3869 12.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8787 11.3598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3723 10.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8643 9.6279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9444 7.2757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9329 5.5351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9201 3.8140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9308 5.5562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5605 3.0608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4373 6.4223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4379 6.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9323 5.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4258 4.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4252 4.6888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9187 3.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5015 7.7242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4999 7.7385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5158 9.4762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0193 10.3278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5433 11.0303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5160 9.4562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0095 8.5931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0062 8.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5143 9.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0208 10.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5288 11.2023 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 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 3 18 1 0 0 0 0 19 15 1 0 0 0 0 20 8 1 0 0 0 0 4 3 1 0 0 0 0 1 21 1 0 0 0 0 14 22 1 0 0 0 0 27 33 1 0 0 0 32 26 1 0 0 0 26 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 32 33 1 1 0 0 28 19 1 1 0 0 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 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 39 20 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 21 1 1 0 0 51 45 1 6 0 0 52 46 1 1 0 0 53 47 1 6 0 0 M END > LMPK12112135 > Quercetin 3,7,4'-triglucoside > > C33H40O22 > 788.20 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > JWSWVKOHVSHWQA-GZIDCZEMSA-N > InChI=1S/C33H40O22/c34-6-15-19(39)23(43)26(46)31(52-15)49-10-4-12(38)18-14(5-10)50-29(30(22(18)42)55-33-28(48)25(45)21(41)17(8-36)54-33)9-1-2-13(11(37)3-9)51-32-27(47)24(44)20(40)16(7-35)53-32/h1-5,15-17,19-21,23-28,31-41,43-48H,6-8H2/t15-,16-,17-,19-,20-,21-,23+,24+,25+,26-,27-,28-,31-,32-,33+/m1/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=CC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)=C(O)C=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 101599893 > - > - > - > - > - > 33090 > - $$$$