LMPK12111973 LIPID_MAPS_STRUCTURE_DATABASE 105115 0 0 0 0 0 0 0 0999 V2000 18.4670 17.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4670 16.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3548 15.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2427 16.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2427 17.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3548 17.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5790 15.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6912 16.1967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8031 15.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8031 14.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6912 14.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5790 14.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9151 16.1967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0272 15.6839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0272 14.6587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9151 14.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6898 13.1722 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9592 15.9302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6297 13.9534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9894 17.6531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9151 13.2768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0787 12.4659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6459 13.3821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5021 11.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5226 11.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9461 10.4984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3494 9.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7730 8.7312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7934 8.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3901 9.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9666 10.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2168 7.6976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9846 13.9585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2795 12.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2793 15.9270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1346 15.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1346 14.4506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2793 13.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4296 14.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4296 15.4347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5796 15.9269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7754 11.0691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3734 9.6869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4804 10.2110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6292 12.5445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5810 12.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8289 11.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1253 10.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1789 10.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9309 11.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9844 12.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3456 7.9751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3490 6.2772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3849 6.2935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8907 8.8447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8774 8.8392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3635 7.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8628 7.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8808 7.1412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3948 7.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4127 8.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6516 13.6562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3016 14.3930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5574 13.8556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8479 13.0780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9503 13.2378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5763 14.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5626 14.3457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9228 13.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 12.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3109 12.4368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9104 13.6978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9740 12.7270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1657 12.7068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8237 10.7678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9772 10.0983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5616 12.6659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4744 10.3797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4884 13.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2423 12.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0697 11.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1464 11.0658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3925 11.6984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4691 11.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6321 8.4175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0113 7.2997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2381 8.1446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7747 10.2431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3835 9.4122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6667 9.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7455 8.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9324 8.2807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0458 8.7033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9671 9.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0805 10.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6827 7.4680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7812 6.9754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6094 9.5706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5641 9.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2550 9.1198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9915 8.1687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0409 7.9226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3499 8.6234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3992 8.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2058 9.3660 0.0000 O 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 5 20 1 0 0 0 0 16 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 29 32 1 0 0 0 0 40 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 37 33 1 6 0 0 38 34 1 6 0 0 50 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 46 34 1 1 0 0 47 42 1 6 0 0 48 43 1 6 0 0 49 44 1 1 0 0 60 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 0 0 0 56 43 1 1 0 0 57 52 1 6 0 0 58 53 1 6 0 0 59 54 1 1 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 64 65 2 0 0 0 0 65 66 1 0 0 0 0 66 67 2 0 0 0 0 67 68 1 0 0 0 0 68 69 2 0 0 0 0 69 70 1 0 0 0 0 70 71 2 0 0 0 0 71 66 1 0 0 0 0 69 72 1 0 0 0 0 62 73 2 0 0 0 39 63 1 1 0 0 36 18 1 1 0 0 60 61 1 6 0 0 50 51 1 6 0 0 40 41 1 6 0 0 78 84 1 0 0 0 83 77 1 0 0 0 77 79 1 0 0 0 79 80 1 0 0 0 80 81 1 0 0 0 81 82 1 0 0 0 82 83 1 0 0 0 83 84 1 1 0 0 80 74 1 6 0 0 81 75 1 1 0 0 82 76 1 6 0 0 89 95 1 0 0 0 94 88 1 0 0 0 88 90 1 0 0 0 90 91 1 0 0 0 91 92 1 0 0 0 92 93 1 0 0 0 93 94 1 0 0 0 94 95 1 1 0 0 90 78 1 1 0 0 91 85 1 6 0 0 92 86 1 1 0 0 93 87 1 6 0 0 103 98 1 0 0 0 98 99 1 0 0 0 99100 1 0 0 0 100101 1 0 0 0 101102 1 0 0 0 102103 1 0 0 0 103104 1 6 0 0 99 75 1 1 0 0 101 96 1 6 0 0 102 97 1 1 0 0 100105 1 6 0 0 79 19 1 1 0 0 74 22 1 0 0 0 0 M END > LMPK12111973 > Kaempferol 3-glucosyl-(1->6)-[rhamnosyl-(1->3)-(2''-(E)-p-coumaroylglucoside)]-7-rhamnosyl-(1->3)-rhamnosyl-(1->3)-(4''-(E)-p-coumaroylrhamnoside) > 7-[[O-6-Deoxy-alpha-L-mannopyranosyl-(1->3)-O-6-deoxy-alpha-L-mannopyranosyl-(1->3)-6-deoxy-4-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-alpha-L-mannopyranosyl]oxy]-3-[[O-6-deoxy-alpha-L-mannopyranosyl-(1->3)-O-[beta-D-glucopyranosyl-(1->6)]-2-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one > C69H82O36 > 1486.46 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > HRAYYNRXNPLKFE-FXJZBFEWSA-N > InChI=1S/C69H82O36/c1-25-43(77)49(83)53(87)65(92-25)102-59-45(79)27(3)94-68(55(59)89)104-62-56(90)67(95-28(4)57(62)100-40(75)19-9-29-5-13-32(71)14-6-29)96-35-21-36(74)42-37(22-35)97-58(31-11-17-34(73)18-12-31)61(48(42)82)105-69-63(101-41(76)20-10-30-7-15-33(72)16-8-30)60(103-66-54(88)50(84)44(78)26(2)93-66)47(81)39(99-69)24-91-64-52(86)51(85)46(80)38(23-70)98-64/h5-22,25-28,38-39,43-47,49-57,59-60,62-74,77-81,83-90H,23-24H2,1-4H3/b19-9+,20-10+/t25-,26-,27-,28-,38+,39+,43-,44-,45-,46+,47+,49+,50+,51-,52+,53+,54+,55+,56+,57-,59+,60-,62-,63+,64+,65-,66-,67-,68-,69-/m0/s1 > C1C=C(O)C=CC=1C1=C(O[C@H]2[C@H](OC(/C=C/C3C=CC(O)=CC=3)=O)[C@@H](O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)O2)C(=O)C2C(O)=CC(O[C@H]3[C@H](O)[C@H](O[C@H]4[C@H](O)[C@H](O[C@H]5[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O5)[C@@H](O)[C@H](C)O4)[C@@H](OC(=O)/C=C/C4C=CC(O)=CC=4)[C@H](C)O3)=CC=2O1 > - > - > - > - > - > - > 21576491 > - > - > - > - > - > 33090; 79580 > - $$$$