"LM_ID" "COMMON_NAME" "SYSTEMATIC_NAME" "FORMULA" "MASS" "CATEGORY" "MAIN_CLASS" "SUB_CLASS" "CLASS_LEVEL4" "SYNONYMS" "INCHI_KEY" "INCHI" "SMILES" "KEGG_ID" "HMDBID" "CHEBI_ID" "ABBREVIATION" "PUBCHEM_COMPOUND_ID" "LIPIDBANK_ID" "SWISSLIPIDS_ID" "CAYMAN_ID" "ALT_CATEGORIES" "ALT_MAIN_CLASSES" "ALT_SUB_CLASSES" "ALT_CLASS_LEVEL4S" "TAXONOMY" "CITATION" "LMPK12010078" "-" "Pelargonidin 3-O-[2-O-(6-(E)-feruloyl-beta-D-glucopyranosyl)-6-O-(E)-p-coumaroyl-beta-D-glucopyranoside]-5-O-(beta-D-glucopyranoside)" "C52H55O25" "1079.303251" "Polyketides [PK]" "Flavonoids [PK12]" "Anthocyanidins [PK1201]" "-" "-" "XOXJWVANDYFNOK-NELIWPSSSA-O" "InChI=1S/C52H54O25/c1-68-33-16-24(4-13-30(33)57)6-15-39(59)69-21-36-41(61)44(64)47(67)51(75-36)77-49-45(65)42(62)37(22-70-38(58)14-5-23-2-9-26(54)10-3-23)76-52(49)73-34-19-29-31(71-48(34)25-7-11-27(55)12-8-25)17-28(56)18-32(29)72-50-46(66)43(63)40(60)35(20-53)74-50/h2-19,35-37,40-47,49-53,60-67H,20-22H2,1H3,(H3-,54,55,56,57,58,59)/p+1/t35-,36-,37-,40-,41-,42-,43+,44+,45+,46-,47-,49-,50-,51+,52-/m1/s1" "C1(O)=CC2[O+]=C(C3C=CC(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](COC(/C=C/C5C=C(OC)C(O)=CC=5)=O)O4)[C@@H](O)[C@H](O)[C@@H](COC(/C=C/C4C=CC(O)=CC=4)=O)O3)=CC=2C(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)=C1" "-" "-" "-" "-" "5320452" "-" "-" "-" "-" "-" "-" "-" "33090; 3726" "11985855"