LMPK12112455 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 0 0 0 0 0999 V2000 12.8669 12.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9806 13.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9806 14.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8669 14.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7530 14.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7530 13.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0946 12.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2086 13.3736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3224 12.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3224 11.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2086 11.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0946 11.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4362 13.3736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5503 12.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5503 11.8388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4362 11.3272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2086 10.4505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6641 13.3736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9806 11.3272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4362 10.4702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6391 14.9083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8669 15.9315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5937 12.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5915 10.1720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4187 8.1982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6263 7.3651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9844 9.9025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0951 7.5154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8838 10.3236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6951 9.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6073 8.7662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7111 8.3499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8997 8.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0034 8.5015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2223 11.2968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0121 10.4467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1677 8.4760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5658 8.7593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4849 9.7491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3003 10.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1967 9.8842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2745 8.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4592 8.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5370 7.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 1 1 0 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 7 2 0 0 0 0 9 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 10 1 0 0 0 0 14 18 1 0 0 0 0 11 17 2 0 0 0 0 12 19 1 0 0 0 0 16 20 1 0 0 0 0 5 21 1 0 0 0 0 4 22 1 0 0 0 0 6 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 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 0 0 0 33 34 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 43 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 0 0 0 43 44 1 6 0 0 39 24 1 1 0 0 40 35 1 6 0 0 41 36 1 6 0 0 42 37 1 1 0 0 29 19 1 1 0 0 M END > LMPK12112455 > Myricetin 3-neohesperidoside > 3-[[2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one > C27H30O17 > 626.15 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > LUITYVJNCILVDI-RXRKALEDSA-N > InChI=1S/C27H30O17/c1-7-16(33)20(37)22(39)26(40-7)44-25-21(38)18(35)14(6-28)42-27(25)43-24-19(36)15-10(30)4-9(29)5-13(15)41-23(24)8-2-11(31)17(34)12(32)3-8/h2-5,7,14,16,18,20-22,25-35,37-39H,6H2,1H3/t7-,14+,16-,18+,20+,21-,22+,25+,26-,27-/m0/s1 > C1C(O)=C(O)C(O)=CC=1C1=C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)C(=O)C2C(O)=CC(O)=CC=2O1 > - > - > - > - > - > - > 21577859 > - > - > - > - > - > 33090; 113208 > - $$$$