4-O-feruloylquinic acid (CHEBI:176888)

CHEBI:176888 - 4-O-feruloylquinic acid

Formula	C17H20O9
Net Charge	0
Average Mass	368.338
Monoisotopic Mass	368.11073
SMILES	COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)C[C@](O)(C(=O)O)C[C@H]2O)ccc1O
InChI	InChI=1S/C17H20O9/c1-25-13-6-9(2-4-10(13)18)3-5-14(21)26-15-11(19)7-17(24,16(22)23)8-12(15)20/h2-6,11-12,15,18-20,24H,7-8H2,1H3,(H,22,23)/b5-3+/t11-,12-,15-,17+/m1/s1
InChIKey	VTMFDSJJVNQXLT-KSQYBWRXSA-N

ChEBI Ontology

Outgoing Relation(s)
	4-O-feruloylquinic acid (CHEBI:176888) is a organic molecular entity (CHEBI:50860)

Citations