LMPK12112097 LIPID_MAPS_STRUCTURE_DATABASE 43 47 0 0 0 0 0 0 0 0999 V2000 7.4471 12.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4471 11.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3101 10.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 11.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1730 12.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3101 12.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0358 10.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8989 11.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8989 12.0964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0358 12.5945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0358 9.8249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9852 12.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8649 12.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7443 12.7864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7443 13.8021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8649 14.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9852 13.8021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3101 9.6058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6855 14.3453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6792 12.5945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7726 10.4647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8649 15.3250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4485 9.3516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2753 7.3734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4788 6.5384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8355 9.0815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9441 6.6890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7370 9.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5501 8.9343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4621 7.9427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5639 7.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7507 8.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8523 7.6773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0829 10.4789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8768 9.6269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0328 7.6518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4250 7.9358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3439 8.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1610 9.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0594 9.0632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1376 8.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3204 7.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3983 6.5246 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 1 1 0 0 0 0 21 8 1 0 0 0 0 4 3 1 0 0 0 0 16 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 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 0 0 42 37 1 0 0 0 37 38 1 0 0 0 38 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 6 0 0 38 23 1 1 0 0 39 34 1 6 0 0 40 35 1 6 0 0 41 36 1 1 0 0 28 21 1 1 0 0 M END > LMPK12112097 > Quercetin 3-neohesperidoside > 3-[2-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)oxy]-3',4',5,7-tetrahydroxyflavone > C27H30O16 > 610.15 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > FYBMGZSDYDNBFX-GXPPAHCZSA-N > InChI=1S/C27H30O16/c1-8-17(33)20(36)22(38)26(39-8)43-25-21(37)18(34)15(7-28)41-27(25)42-24-19(35)16-13(32)5-10(29)6-14(16)40-23(24)9-2-3-11(30)12(31)4-9/h2-6,8,15,17-18,20-22,25-34,36-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,25+,26-,27-/m0/s1 > C1(O)=CC2OC(C3C=C(O)C(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > 143037 > - > - > - > 5491657 > - > - > - > - > - > 33090; 4577 > - $$$$