LMPK12140434 LIPID_MAPS_STRUCTURE_DATABASE 42 46 0 0 0 999 V2000 13.3103 2.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2222 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1345 2.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1345 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2222 3.7713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3103 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0463 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9582 2.1918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9582 3.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0463 3.7713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0463 0.7479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2222 0.6132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4231 3.7569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9731 3.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8991 3.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8249 3.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8249 4.8381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8991 5.3726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9731 4.8381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7102 5.3491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8991 6.4248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7654 6.8752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7638 1.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7925 1.5349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5108 3.0663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8192 4.3561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2571 4.5997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4652 3.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1230 2.6481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1346 2.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 3.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8361 4.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1953 4.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6003 -0.1029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9543 -1.5226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2280 0.9507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2457 1.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6253 0.1212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8670 -0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0024 -0.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8670 -0.5304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3670 0.3356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21 22 1 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 3 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 4 1 0 0 0 0 7 11 2 0 0 0 0 2 12 1 0 0 0 0 6 13 1 0 0 0 0 9 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 18 1 0 0 0 0 18 19 2 0 0 0 0 19 14 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 27 33 1 0 0 0 32 26 1 0 0 0 26 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 29 23 1 6 0 0 30 24 1 1 0 0 31 25 1 6 0 0 40 36 1 0 0 0 40 39 1 0 0 0 36 37 1 0 0 0 39 38 1 0 0 0 37 38 1 0 0 0 37 23 1 1 0 0 38 34 1 6 0 0 39 35 1 6 0 0 39 41 1 0 0 0 41 42 1 0 0 0 28 13 1 1 0 0 M END > LMPK12140434 > Viscumneoside III > > C27H32O15 > 596.17 > Polyketides [PK] > Flavonoids [PK12] > Flavanones [PK1214] > - > > BYALYZGUSBVZQP-JTMXOKNDSA-N > InChI=1S/C27H32O15/c1-37-17-4-11(2-3-13(17)30)16-7-15(32)20-14(31)5-12(6-18(20)40-16)39-25-23(22(34)21(33)19(8-28)41-25)42-26-24(35)27(36,9-29)10-38-26/h2-6,16,19,21-26,28-31,33-36H,7-10H2,1H3/t16?,19-,21-,22+,23-,24+,25-,26+,27-/m1/s1 > C1C(O[C@H]2[C@H](O[C@H]3[C@H](O)[C@](CO)(O)CO3)[C@@H](O)[C@H](O)[C@@H](CO)O2)=CC2OC(C3C=C(OC)C(O)=CC=3)CC(=O)C=2C=1O > - > - > - > - > - > - > 11968306 > - > - > - > - > - > 159976 > - $$$$