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4-Feruloyl-1,5-quinolactone

Properties

Image

Occurences in reactions

MNX_ID

MNXM117895

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₇H₁₈O₈

charge

mass

350.10017

reference

chebi:175471

InChIKey

OIGFDFULTVHQNZ-KJJWLSQTSA-N

InChI

InChI=1S/C17H18O8/c1-23-12-6-9(2-4-10(12)18)3-5-14(20)25-15-11(19)7-17(22)8-13(15)24-16(17)21/h2-6,11,13,15,18-19,22H,7-8H2,1H3/b5-3+/t11-,13-,15-,17+/m1/s1

SMILES

COc1cc(/C=C/C(=O)O[C@@H]2[C@H](O)C[C@]3(O)C[C@H]2OC3=O)ccc1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:175471 chebi:175471	4-Feruloyl-1,5-quinolactone [(1S,3R,4R,5R)-1,3-dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
hmdb:HMDB0029290	4-Feruloyl-1,5-quinolactone (1S,3R,4R,5R)-1,3-Dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid (1S,3R,4R,5R)-1,3-dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate 4-Feruloyl-1,5-quinide 4-Feruloylquinic acid lactone 4-Feruloylquinic-1,5-lactone
hmdb:HMDB29290	secondary/obsolete/fantasy identifier