LMPK12020266 LIPID_MAPS_STRUCTURE_DATABASE 41 45 0 0 0 999 V2000 9.8009 13.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8009 12.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6868 11.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5728 12.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5728 13.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6868 13.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 11.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3445 12.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3445 13.2152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 13.7268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2306 13.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1238 13.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0170 13.7268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0170 14.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1238 15.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2306 14.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9091 15.2732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9151 13.7268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1238 16.3040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6828 10.6756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1382 7.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4665 7.2095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0174 7.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8165 6.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8165 5.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6898 5.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5633 5.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5633 6.9485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6898 7.4529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4349 5.4366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4349 7.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8951 7.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1511 8.7461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 8.2418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8137 9.6656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0114 11.1361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7168 10.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4510 9.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4797 9.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7797 9.9184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0455 10.8831 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 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 5 1 0 0 0 0 9 11 1 6 0 0 0 11 12 2 0 0 0 0 12 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 11 1 0 0 0 0 14 17 1 0 0 0 0 1 18 1 0 0 0 0 15 19 1 0 0 0 0 20 3 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 24 1 0 0 0 0 27 30 1 0 0 0 0 28 31 1 0 0 0 0 23 32 2 0 0 0 0 24 32 1 0 0 0 0 41 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 40 41 1 0 0 0 37 20 1 1 0 0 38 33 1 6 0 0 39 34 1 1 0 0 40 35 1 6 0 0 33 21 1 0 0 0 0 M END > LMPK12020266 > Viscutin 2 > 5,7,3',4'-Tetrahydroxyflavan 5-O- (2-caffeoyl-beta-D-xylopyranoside) > C29H28O12 > 568.16 > Polyketides [PK] > Flavonoids [PK12] > Flavans, Flavanols and Leucoanthocyanidins [PK1202] > - > > QTZATSRJHQIPRH-MSWXGZRYSA-N > InChI=1S/C29H28O12/c30-16-11-24-17(4-7-23(39-24)15-3-6-19(32)21(34)10-15)25(12-16)40-29-28(27(37)22(35)13-38-29)41-26(36)8-2-14-1-5-18(31)20(33)9-14/h1-3,5-6,8-12,22-23,27-35,37H,4,7,13H2/b8-2+/t22-,23+,27+,28-,29+/m1/s1 > C1(O)C=C2O[C@H](C3C=C(O)C(O)=CC=3)CCC2=C(O[C@H]2[C@H](OC(/C=C/C3C=C(O)C(O)=CC=3)=O)[C@@H](O)[C@H](O)CO2)C=1 > - > - > - > - > - > - > 178335929 > - > - > - > - > - > 33090; 1874191 > - $$$$