1.0 2026-09-22 20:02:32 UTC 2026-09-22 20:03:27 UTC FDB118797 Coumarylquinic acid coumarylquinic acid trans-(3R,5R)-2-(2,3-dihydrobenzofuran-2-yl)-1,3,4,5-tetrahydroxy-cyclohexanecarboxylic acid C15H18O7 310.3 C1[C@H](C([C@@H](C(C1(C(=O)O)O)C2CC3=CC=CC=C3O2)O)O)O InChI=1S/C15H18O7/c16-8-6-15(21,14(19)20)11(13(18)12(8)17)10-5-7-3-1-2-4-9(7)22-10/h1-4,8,10-13,16-18,21H,5-6H2,(H,19,20)/t8-,10?,11?,12?,13-,15?/m1/s1 MGPHIRHDXIPJMH-ATSPUTDMSA-N average_mass 310.3 ChemAxon smiles C1[C@H](C([C@@H](C(C1(C(=O)O)O)C2CC3=CC=CC=C3O2)O)O)O ChemAxon formula C15H18O7 ChemAxon inchi InChI=1S/C15H18O7/c16-8-6-15(21,14(19)20)11(13(18)12(8)17)10-5-7-3-1-2-4-9(7)22-10/h1-4,8,10-13,16-18,21H,5-6H2,(H,19,20)/t8-,10?,11?,12?,13-,15?/m1/s1 ChemAxon inchikey MGPHIRHDXIPJMH-ATSPUTDMSA-N ChemAxon