CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
---|
COMPUTED DESCRIPTORS
Molecular Weight | 336.5 g/mol |
---|---|
XLogP3 | 4 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 14 |
Exact Mass | 336.23005950 g/mol |
Monoisotopic Mass | 336.23005950 g/mol |
Topological Polar Surface Area | 77.8 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 421 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 4 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
5(S),15(S)-DiHETE is a DiHETE that is (6E,8Z,11Z,13E)-icosatetraenoic acid in which the two hydroxy substituents are placed at the 5S- and 15S-positions. It has a role as a rat metabolite and a human xenobiotic metabolite. It is a conjugate acid of a 5(S),15(S)-DiHETE(1-).