Title: Identification and urinary excretion of metabolites of 5-(hydroxymethyl)-2-furfural in human subjects following consumption of dried plums or dried plum juice.
Journal: Journal of agricultural and food chemistry 20060517
Chemical Name:
Glycine, N-[[5-(hydroxymethyl)-2-furanyl]carbonyl]-
CAS Number:
38716-68-6
Molecular Formula:
C8H9NO5
Molecular Weight:
199.1608
SMILES:
OCc1ccc(o1)C(=O)NCC(=O)O
Properties
Complexity:
230
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Rotatable Bond Count:
4
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
Literature
Title: Identification and urinary excretion of metabolites of 5-(hydroxymethyl)-2-furfural in human subjects following consumption of dried plums or dried plum juice.
Journal: Journal of agricultural and food chemistry20060517