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Cholesteryl palmitoleate

Cholesteryl palmitoleate structure

CAS No:
16711-66-3
Formula:
C43H74O2
Chemical Name:
Cholesteryl palmitoleate
Synonyms:
Cholest-5-en-3-ol (3β)-,3-[(9Z)-9-hexadecenoate];Cholesterol,9-hexadecenoate,(Z)-;Cholest-5-en-3-ol (3β)-,9-hexadecenoate,(Z)-;Cholest-5-en-3-ol (3β)-,(9Z)-9-hexadecenoate;Cholesteryl palmitoleate;Cholesterol palmitoleate;Cholesteryl cis-hexadecenoate;19242-52-5
Categories:
Biochemical Engineering > Lipids

Description

ChEBI: A cholesterol ester obtained by the formal condensation of cholesterol with palmitoleic acid.

Solid

Cholesteryl palmitoleate is a cholesterol ester obtained by the formal condensation of cholesterol with palmitoleic acid. It has a role as a mouse metabolite. It derives from a palmitoleic acid.

Cholesteryl palmitoleate Basic Attributes

Molecular Weight：

623.04646

Exact Mass：

623.05

UNII：

132TTN4QMV

Characteristics

PSA：

26.3

XLogP3：

15.5

Melting Point：

49.5-50.5 °C @ Solvent: Acetone

Storage Conditions：

−20°C

Collision Cross Section：

284.8 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|284.1 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|291.4 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|277.44 Å² [M+NH4]+ [CCS Type: TIMS, Method: single field calibrated]

Drug Information

MeSH Entry Terms：

cholesteryl 9-hexadecenoate

Cholesteryl palmitoleate Use and Manufacturing

Use Classification：

Lipids -> Sterol Lipids [ST] -> Sterols [ST01] -> Steryl esters [ST0102]

Computed Properties

Molecular Weight:623.0
XLogP3:15.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:20
Exact Mass:622.56888160
Monoisotopic Mass:622.56888160
Topological Polar Surface Area:26.3
Heavy Atom Count:45
Complexity:946
Defined Atom Stereocenter Count:8
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Cholesteryl palmitoleate

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Cholesteryl palmitoleate

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