604-33-1
Product Name:
Cholesteryl linoleate
Formula:
C45H76O2
Synonyms:
3β-Hydroxy-5-cholestene 3-linoleate;5-Cholesten-3β-ol 3-linoleate;Cholesteryl 9,12-octadecadienoate;Cholesteryl octadecadienoate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 290.83 Ų [M+NH4]+ [CCS Type: DT; Buffer gas: N2; Sample Type: Human plasma; Dataset: Unambiguous Lipids] |
|---|---|
| Chemical Classes | Lipids -> Unambiguous Lipids |
COMPUTED DESCRIPTORS
| Molecular Weight | 649.1 g/mol |
|---|---|
| XLogP3 | 15.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 21 |
| Exact Mass | 648.58453166 g/mol |
| Monoisotopic Mass | 648.58453166 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 47 |
| Formal Charge | 0 |
| Complexity | 1020 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Cholesteryl linoleate is the (9Z,12Z)-stereoisomer of cholesteryl octadeca-9,12-dienoate. It has a role as a human metabolite and a mouse metabolite. It is a cholesteryl octadeca-9,12-dienoate and a CE(18:2). It is functionally related to a linoleic acid.