LMPK12110264 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 7.1050 -3.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 -4.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9632 -5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8214 -4.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8214 -3.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9632 -3.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6796 -5.0372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5378 -4.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5378 -3.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6796 -3.0551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6796 -5.8098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2471 -3.0554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9632 -6.0278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4911 -3.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3954 -3.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2999 -3.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2999 -1.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3954 -1.4572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4911 -1.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2035 -1.4575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2466 -2.1203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2467 -0.1186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9774 0.8778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8467 -1.6196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5316 0.8613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9786 -2.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -1.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1134 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9787 -0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8453 -0.6211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7107 -0.1230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5457 2.8627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2863 3.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0074 2.8383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2652 0.8490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7607 1.4787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3992 1.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4063 2.3562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2794 2.8505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1398 2.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1327 1.3434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9932 0.8369 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 1 12 1 0 0 0 0 3 13 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 14 9 1 0 0 0 0 17 20 1 0 0 0 0 25 31 1 0 0 0 30 24 1 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 1 0 0 27 21 1 6 0 0 28 22 1 1 0 0 29 23 1 6 0 0 26 6 1 1 0 0 36 42 1 0 0 0 41 35 1 0 0 0 35 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 1 0 0 37 25 1 1 0 0 38 32 1 6 0 0 39 33 1 1 0 0 40 34 1 6 0 0 M END > LMPK12110264 > Vitexin 6''-O-glucoside > > C27H30O15 > 594.16 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > QHYZEVPULSDUSA-WIQAIWCDSA-N > InChI=1S/C27H30O15/c28-7-15-19(33)22(36)24(38)27(42-15)39-8-16-20(34)21(35)23(37)26(41-16)18-12(31)5-11(30)17-13(32)6-14(40-25(17)18)9-1-3-10(29)4-2-9/h1-6,15-16,19-24,26-31,33-38H,7-8H2/t15-,16-,19-,20-,21+,22+,23-,24-,26+,27-/m1/s1 > C1(O)=C([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)O2)C2OC(C3C=CC(O)=CC=3)=CC(=O)C=2C(O)=C1 > - > - > - > - > - > - > 44257720 > - > - > - > - > - > 33090 > - $$$$