LMPK12010432 LIPID_MAPS_STRUCTURE_DATABASE 37 41 0 0 0 999 V2000 8.5952 10.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4882 10.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4882 11.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5952 12.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7018 11.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7018 10.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5952 9.1618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4882 8.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3816 9.1618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3816 10.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2748 10.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2748 11.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3816 12.2561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8356 12.2406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4882 7.6849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6608 7.2070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3370 7.1948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0853 12.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9416 11.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7978 12.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7978 13.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9416 13.6914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0853 13.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9416 14.4307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5488 13.6308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1177 10.2223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0841 10.7343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5109 9.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9698 7.3331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5611 8.5189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8344 6.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8304 9.5013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8135 9.7573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5278 9.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2571 8.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2740 7.7981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0034 6.8211 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 1 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 2 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 3 1 0 0 0 0 5 14 1 0 0 0 0 8 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 12 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 18 1 0 0 0 0 22 24 1 0 0 0 0 21 25 1 0 0 0 0 11 26 1 0 0 0 0 31 37 1 0 0 0 36 30 1 0 0 0 30 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 1 0 0 32 26 1 1 0 0 33 27 1 6 0 0 34 28 1 1 0 0 35 29 1 6 0 0 M CHG 1 13 1 M END > LMPK12010432 > 5-Carboxypyranocyanidin 3-O-beta-glucopyranoside > 2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-7-hydroxy-10-carboxy-5,4-(epoxyetheno)-1-benzopyrylium > C24H21O13 > 517.10 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > DTHNDBFHAFORNZ-KXJGTOPRSA-O > InChI=1S/C24H20O13/c25-7-16-18(29)19(30)20(31)24(36-16)37-22-10-6-15(23(32)33)34-13-4-9(26)5-14(17(10)13)35-21(22)8-1-2-11(27)12(28)3-8/h1-6,16,18-20,24-25,29-31H,7H2,(H3-,26,27,28,32,33)/p+1/t16-,18-,19+,20-,24+/m1/s1 > C12OC(C(O)=O)=CC3=C(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O4)C(C4C=C(O)C(O)=CC=4)=[O+]C(=CC(O)=C1)C=23 > - > - > - > - > - > - > 44257032 > - > - > - > - > - > 33090; 4679 > 12648539 $$$$