LMPK12111704 LIPID_MAPS_STRUCTURE_DATABASE 64 70 0 0 0 0 0 0 0 0999 V2000 11.1792 12.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1792 11.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0345 10.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8900 11.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8900 12.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0345 12.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7455 10.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6009 11.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6009 12.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7455 12.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7455 9.8430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6779 12.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5499 12.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4216 12.7787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4216 13.7855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5499 14.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6779 13.7855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0345 9.6256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3546 14.3243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3863 12.7925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6197 10.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4676 5.0548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9809 6.2308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5590 5.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7173 5.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3883 4.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4162 4.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7734 5.8074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1022 6.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0743 6.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7999 5.9884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2042 10.8688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4470 10.0645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8768 11.1835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7199 12.9502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2668 12.5546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5103 12.3902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4192 11.4284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5378 11.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7530 11.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8440 12.5477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0589 13.1072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0910 9.2202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7420 7.3192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9248 6.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5348 9.1978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4467 9.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1825 8.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0061 7.9454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0977 7.6232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3619 8.2495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4534 7.9273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1662 6.6433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2960 6.1564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9440 7.5310 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0658 8.9509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7469 8.2620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4902 7.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5525 7.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8767 7.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1333 8.7066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4574 9.3939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6653 8.4849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8212 6.0263 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 4 3 1 0 0 0 0 1 20 1 0 0 0 0 21 8 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 25 1 0 0 0 0 28 31 1 0 0 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 20 1 1 0 0 38 32 1 6 0 0 39 33 1 1 0 0 40 34 1 6 0 0 51 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 50 51 1 0 0 0 51 52 1 1 0 0 47 21 1 1 0 0 48 43 1 6 0 0 49 44 1 1 0 0 50 45 1 1 0 0 61 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 60 61 1 0 0 0 61 62 1 6 0 0 58 53 1 6 0 0 59 54 1 6 0 0 60 55 1 1 0 0 52 63 1 0 0 0 57 63 1 1 0 0 64 22 2 0 0 0 0 64 23 1 0 0 0 0 45 64 1 0 0 0 0 M END > LMPK12111704 > Variabiloside C > 3,5,7,4'-Tetrahydroxyflavone 3-(4"-(E)-p-coumarylrobinobioside)-7-glucoside > C42H46O22 > 902.25 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > YUDSUZANKRPJIV-UVKOFWPCSA-N > InChI=1S/C42H46O22/c1-16-28(48)31(51)34(54)40(58-16)57-15-25-38(63-26(47)11-4-17-2-7-19(44)8-3-17)33(53)36(56)42(62-25)64-39-30(50)27-22(46)12-21(59-41-35(55)32(52)29(49)24(14-43)61-41)13-23(27)60-37(39)18-5-9-20(45)10-6-18/h2-13,16,24-25,28-29,31-36,38,40-46,48-49,51-56H,14-15H2,1H3/b11-4+/t16-,24+,25+,28-,29+,31+,32-,33+,34+,35+,36+,38-,40+,41+,42-/m0/s1 > C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=CC(O)=CC=3)=C(O[C@H]3[C@H](O)[C@@H](O)[C@@H](OC(/C=C/C4C=CC(O)=CC=4)=O)[C@@H](CO[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)O3)C(=O)C=2C(O)=C1 > - > - > - > - > - > - > 13942392 > - > - > - > - > - > 33090; 26496 > - $$$$