Trilinolein

CAT: 0607-BA7635-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0607-BA7635-100Size:100 mg

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CAS Number

537-40-6

Form

A liquid

Molecular Formula

C57H98O6

Molecular Weight

879.38

Shipping Conditions

Blue ice

Storage Conditions

Tightly sealed and desiccated at -20°C, protect from light.

Chemical Information

Trilinolein

1,2,3-trilinoleoylglycerol is a triglyceride formed by acylation of the three hydroxy groups of glycerol with linoleic acid. It has a role as a mouse metabolite. It is a TG(18:2/18:2/18:2), a linoleoyl containing 1,2,3-triacyl-sn-glycerol, a triglyceride, a 1,2-diacyl-3-linoleoylglycerol and a 1,3-diacyl-2-linoleoylglycerol. It is functionally related to a linoleic acid.

CAS Number	537-40-6
PubChem CID	5322095
IUPAC Name	2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl (9Z,12Z)-octadeca-9,12-dienoate
Molecular Formula	C57H98O6
Molecular Weight	879.4
XLogP	20.3
Topological Polar Surface Area	78.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	50
Heavy Atom Count	63
Formal Charge	0
Complexity	1130

SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCC/C=C\C/C=C\CCCCC

InChI

InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-,21-18-,28-25-,29-26-,30-27-

InChIKey

HBOQXIRUPVQLKX-BBWANDEASA-N

Chemical Structure

2D Structure

CAS: 537-40-6

CID: 5322095

Formula: C57H98O6

MW: 879.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	879.4
XLogP3	20.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	50
Exact Mass	878.73634084
Monoisotopic Mass	878.73634084
Topological Polar Surface Area	78.9 Å²
Heavy Atom Count	63
Formal Charge	0
Complexity	1130
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	6
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
AB2717	Trilinolein
HY-128393S1	Trilinolein-13C54
HY-128393R	Trilinolein (Standard)

Trilinolein

Chemical Information

Alternative Products

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