7344-02-7
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 |
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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 |
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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.