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Trimyristin

Trimyristin structure

CAS No:
555-45-3
Formula:
C45H86O6
Chemical Name:
Trimyristin
Synonyms:
Tetradecanoic acid,1,1′,1′′-(1,2,3-propanetriyl) ester;Myristin,tri-;Tetradecanoic acid,1,2,3-propanetriyl ester;Glycerol trimyristate;Glyceryl trimyristate;Trimyristin;VP 114;Myristic acid triglyceride;Dynasan 114;Myristic triglyceride;Trimyristoylglycerol;Glycerin trimyristate;Triglyceride MMM;Glyceryl tritetradecanoate;Tritetradecanoin;NSC 4062;Esteride G-M;2,3-Di(tetradecanoyloxy)propyl tetradecanoate
Categories:
Cosmetic Ingredient > Viscosity Controlling

Description

Trimyristin, an active molluscicidal component of Myristica fragrans Houtt, significantly inhibits acetylcholinesterase (AChE), acid and alkaline phosphatase (ACP/ALP) activities in the nervous tissue of Lymnaea acuminata. IC50s of Trimyristin against AChE, ACP, and ALP are 0.11, 0.16 and 0.18 mM, respectively[1].

Solid

Trimyristin is a triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by myristic (tetradecanoic) acid. It is a triglyceride and a tetradecanoate ester.

Trimyristin Basic Attributes

Molecular Weight：

723.177

Exact Mass：

723.16

EC Number：

209-099-7

UNII：

18L31PSR28

NSC Number：

4062

HScode：

2915900090

Characteristics

PSA：

78.9

XLogP3：

18.7

Appearance：

Solid

Density：

0.9±0.1 g/cm3

Melting Point：

56.5 °C

Boiling Point：

311 °C

Flash Point：

270.9±23.8 °C

Refractive Index：

1.464

Water Solubility：

Insoluble in water. Soluble in chloroform, ether, ethanol or dichloromethane

Collision Cross Section：

291.4 Å² [M+Na]+ [CCS Type: DT, Method: single field calibrated with ESI Low Concentration Tuning Mix (Agilent)]|289.67 Å² [M+Na]+ [CCS Type: DT, Method: single field]|291.39 Å² [M+NH4]+ [CCS Type: DT, Method: single field]|294.75 Å² [M+NH4]+ [CCS Type: DT, Method: single field]|294.93 Å² [M+NH4]+ [CCS Type: DT, Method: single field]|290.31 Å² [M+Na]+ [CCS Type: DT, Method: single field]|293.29 Å² [M+NH4]+ [CCS Type: DT, Method: single field]|295.5 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|294.9 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|294.7 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|294.8 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]|295.3 Å² [M+NH4]+ [CCS Type: TIMS, Method: calibrated with 4 ions from ESI LC/MS tuning mix (Agilent)]

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

S24/25

Drug Information

MeSH Entry Terms：

glyceryl trimyristate

Trimyristin Use and Manufacturing

Manufacturing Info：

Tetradecanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester: ACTIVE

Use Classification：

Lipids -> Glycerolipids [GL] -> Triradylglycerols [GL03] -> Triacylglycerols [GL0301]|Cosmetics -> Emollient; Refatting; Skin conditioning; Solvent; Viscosity controlling

Computed Properties

Molecular Weight:723.2
XLogP3:18.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:44
Exact Mass:722.64244046
Monoisotopic Mass:722.64244046
Topological Polar Surface Area:78.9
Heavy Atom Count:51
Complexity:711
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Trimyristin

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Trimyristin

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