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(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate

(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate structure

CAS No:
53702-48-0
Formula:
C39H74O5
Chemical Name:
(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate
Synonyms:
9-Octadecenoic acid (9Z)-,(1S)-1-(hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl ester;9-Octadecenoic acid (Z)-,1-(hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl ester,(S)-;(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate;D-1-Stearo-2-olein;1-Stearoyl-2-oleoyl-sn-glycerol;1-Stearoyl-2-oleoyl-sn-glycerol;9-Octadecenoic acid (9Z)-,1-(hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl ester,(S)-
Categories:
Biochemical Engineering > Lipids

Description

Solid

1-octadecanoyl-2-[(9Z)-octadecenoyl]-sn-glycerol is a 1,2-diacyl-sn-glycerol that has stearoyl and oleoyl as the 1- and 2-acyl groups respectively. It has a role as a mouse metabolite. It is a 1,2-diacyl-sn-glycerol, a 1-stearoyl-2-oleoylglycerol and a diacylglycerol 36:1. It is an enantiomer of a 2-oleoyl-3-stearoyl-sn-glycerol.

(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate Basic Attributes

Molecular Weight：

623.00200

Exact Mass：

623.00

Characteristics

PSA：

72.83000

XLogP3：

11.73270

Density：

0.928g/cm3

Boiling Point：

668.2ºC

Flash Point：

184.7ºC

Drug Information

MeSH Entry Terms：

1-stearoyl-2-oleoyl-sn-glycerol

(1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate Use and Manufacturing

Use Classification：

Lipids -> Glycerolipids [GL] -> Diradylglycerols [GL02] -> Diacylglycerols [GL0201]

Computed Properties

Molecular Weight:623.0
XLogP3:15.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:37
Exact Mass:622.55362546
Monoisotopic Mass:622.55362546
Topological Polar Surface Area:72.8
Heavy Atom Count:44
Complexity:632
Defined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (1S)-1-(Hydroxymethyl)-2-[(1-oxooctadecyl)oxy]ethyl (9Z)-9-octadecenoate

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

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