LMPK12110585 LIPID_MAPS_STRUCTURE_DATABASE 44 48 0 0 0 0 0 0 0 0999 V2000 7.8026 12.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8026 11.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6854 10.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5680 11.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5680 12.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6854 12.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4506 10.9115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3333 11.4213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3333 12.4403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4506 12.9500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4506 10.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2157 12.9498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1153 12.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0148 12.9498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0148 13.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1153 14.5077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2157 13.9885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6854 10.1293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9204 12.9498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7135 14.3920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9587 10.8041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1153 15.1572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9405 15.6336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5382 9.4683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1809 7.4421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2512 6.7425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8167 9.4256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6807 7.0364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7854 9.7798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5732 9.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3928 8.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4281 7.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6401 8.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6752 8.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3271 10.4843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1018 9.4429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0845 7.3901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4182 7.9189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4243 8.9500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3186 9.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2073 8.9348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1985 7.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3044 7.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2956 6.3742 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 3 4 1 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 1 19 1 0 0 0 0 15 20 1 0 0 0 0 8 21 1 0 0 0 0 16 22 1 0 0 0 0 22 23 1 0 0 0 0 28 34 1 0 0 0 33 27 1 0 0 0 27 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 0 0 0 33 34 1 1 0 0 30 24 1 6 0 0 31 25 1 1 0 0 32 26 1 6 0 0 43 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 0 0 0 42 43 1 0 0 0 43 44 1 6 0 0 39 24 1 1 0 0 40 35 1 6 0 0 41 36 1 6 0 0 42 37 1 1 0 0 29 21 1 1 0 0 M END > LMPK12110585 > Isorhamnetin 3-neohesperidoside > 3,4',5,7-Tetrahydroxy-3'-methoxyflavone 3-rhamnosyl-(1->2) glucoside > C28H32O16 > 624.17 > Polyketides [PK] > Flavonoids [PK12] > Flavones and Flavonols [PK1211] > - > > QHLKSZBFIJJREC-SPSUIZEHSA-N > InChI=1S/C28H32O16/c1-9-18(33)21(36)23(38)27(40-9)44-26-22(37)19(34)16(8-29)42-28(26)43-25-20(35)17-13(32)6-11(30)7-15(17)41-24(25)10-3-4-12(31)14(5-10)39-2/h3-7,9,16,18-19,21-23,26-34,36-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,26+,27-,28-/m0/s1 > C1(O)=CC2OC(C3C=C(OC)C(O)=CC=3)=C(O[C@H]3[C@H](O[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O4)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(=O)C=2C(O)=C1 > - > - > 189462 > - > - > - > 11664505 > - > - > - > - > - > 33090; 13187 > - $$$$