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3-p-Coumaroyl-1,5-quinolactone

Properties

Image

Occurences in reactions

MNX_ID

MNXM117604

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

formula

C₁₆H₁₆O₇

charge

mass

320.0896

reference

InChIKey

UDRNBJSMWYQCNZ-OTCYKTEZSA-N

InChI

InChI=1S/C16H16O7/c17-10-4-1-9(2-5-10)3-6-13(18)22-11-7-16(21)8-12(14(11)19)23-15(16)20/h1-6,11-12,14,17,19,21H,7-8H2/b6-3+/t11-,12-,14-,16+/m1/s1

SMILES

O=C(/C=C/c1ccc(O)cc1)O[C@@H]1C[C@]2(O)C[C@@H](OC2=O)[C@@H]1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:175082 chebi:175082	3-p-Coumaroyl-1,5-quinolactone [(1R,3R,4R,5R)-1,4-dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
hmdb:HMDB0029292	3-p-Coumaroyl-1,5-quinolactone (1R,3R,4R,5R)-1,4-Dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-3-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoic acid (1R,3R,4R,5R)-1,4-dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-3-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate 3-Coumaroyl-1,5-lactone 3-Coumaroyl-1,5-quinide 3-Coumaroylquinic acid lactone
hmdb:HMDB29292	secondary/obsolete/fantasy identifier