LMPK12112346 LIPID_MAPS_STRUCTURE_DATABASE 56 61 0 0 0 0 0 0 0 0999 V2000 7.6221 12.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6221 11.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5068 10.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3916 11.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3916 12.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5068 13.0403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2763 10.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1611 11.5076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1611 12.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2763 13.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2763 10.2004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2752 13.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1981 12.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0769 13.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0330 14.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1102 14.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2313 14.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5068 9.9757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9177 14.8640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5653 13.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8673 10.8015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1102 15.8568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9950 16.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 9.6708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2740 7.7276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5023 6.9193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8877 9.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7768 9.8320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5721 9.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4786 8.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5928 7.8888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7974 8.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9115 8.0501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0487 6.6274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3514 5.6636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 6.6512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3719 8.5911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9385 7.9770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2165 8.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2096 7.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3582 6.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5192 7.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 8.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6869 8.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8078 6.3863 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8645 6.5703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0562 8.3419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5606 8.9565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2149 9.8493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 8.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4037 7.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4298 7.3656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0258 8.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5911 9.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 9.9327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0695 8.5418 0.0000 O 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 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 1 0 0 0 0 16 22 1 0 0 0 0 22 23 1 0 0 0 0 32 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 0 0 0 31 32 1 0 0 0 32 33 1 1 0 0 28 21 1 1 0 0 29 24 1 6 0 0 30 25 1 1 0 0 31 26 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 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 38 1 1 0 0 51 45 1 6 0 0 52 46 1 1 0 0 53 47 1 6 0 0 33 56 1 0 0 0 39 56 1 1 0 0 M END > LMPK12112346 > Isorhamnetin 3-gentiotrioside > 3,4',5,7-Tetrahydroxy-3'-methoxyflavone 3-glucosyl-(1->6)-glucoside-(1->6)-glucoside > C34H42O22 > 802.22 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > ZOBQEZZXFJUSHG-JVZAQKPVSA-N > InChI=1S/C34H42O22/c1-49-14-4-10(2-3-12(14)37)30-31(23(42)19-13(38)5-11(36)6-15(19)52-30)56-34-29(48)26(45)22(41)18(55-34)9-51-33-28(47)25(44)21(40)17(54-33)8-50-32-27(46)24(43)20(39)16(7-35)53-32/h2-6,16-18,20-22,24-29,32-41,43-48H,7-9H2,1H3/t16-,17-,18-,20-,21-,22-,24+,25+,26+,27-,28-,29-,32-,33-,34+/m1/s1 > C1(O)=CC2OC(C3C=C(OC)C(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 163010176 > - > - > - > - > - > 33090; 1965241 > - $$$$