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7344-02-7

7344-02-7 structural image
Product Name: N-ARACHIDOYL-D-ERYTHRO-SPHINGOSINE
Formula: C38H75NO3
Synonyms: N-arachidoyl-D-erythro-sphingosine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Solubility Insoluble
Collision Cross Section 256.39 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Sample Type: Human bronchoalveolar lavage fluid (BALF); Dataset: Sphingolipids] 267.1 Ų [M+HCOO]- [CCS Type: DT; Buffer gas: N2; Sample Type: Human bronchoalveolar lavage fluid (BALF); Dataset: Sphingolipids] 269.85 Ų [M+CH3COO]- [CCS Type: DT; Buffer gas: N2; Sample Type: Human bronchoalveolar lavage fluid (BALF); Dataset: Sphingolipids]
Chemical Classes Lipids -> Sphingolipids

COMPUTED DESCRIPTORS

Molecular Weight 594.0 g/mol
XLogP3 15
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 34
Exact Mass 593.57469525 g/mol
Monoisotopic Mass 593.57469525 g/mol
Topological Polar Surface Area 69.6 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 565
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

N-icosanoylsphingosine is a N-acylsphingosine in which the ceramide N-acyl group is specified as eicosanoyl. It has a role as a mouse metabolite. It is a N-acylsphingosine and a Cer(d38:1). It is functionally related to an icosanoic acid.