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N-Octadecanoylsphingosylphosphorylcholine structure
Fine Chemical

N-Octadecanoylsphingosylphosphorylcholine

TL;DR: N-Octadecanoylsphingosylphosphorylcholine (CAS 58909-84-5) is a chemical compound with molecular formula C41H83N2O6P and molecular weight 730.5989 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[3-hydroxy-2-(octadecanoylamino)octadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate

Also Known As: N-stearoylsphingomyelin, 2,3-Sppc, N-STEAROYL-D-SPHINGOMYELIN, N-Octadecanoylsphingosylphosphorylcholine, [3-hydroxy-2-(octadecanoylamino)octadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate

CAS Number
58909-84-5
Molecular Formula
C41H83N2O6P
Molecular Weight
730.5989 g/mol
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Technical Specifications

Molecular FormulaC41H83N2O6P
Molecular Weight730.5989 g/mol
XLogP13.4
Topological Polar Surface Area (TPSA)108.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds38
Exact Mass730.5989 Da
Heavy Atoms50
Complexity826.0
SMILESCCCCCCCCCCCCCCCCCC(=O)NC(COP(=O)([O-])OCC[N+](C)(C)C)C(C=CCCCCCCCCCCCCC)O
InChIKeyLKQLRGMMMAHREN-UHFFFAOYSA-N

Product Description

Applications: N-Octadecanoylsphingosylphosphorylcholine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

N-Octadecanoylsphingosylphosphorylcholine is a fine chemical identified by CAS number 58909-84-5 and the molecular formula C41H83N2O6P and a molecular weight of 730.6 g/mol. Synonyms include N-stearoylsphingomyelin and 2,3-Sppc.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N-Octadecanoylsphingosylphosphorylcholine

XLogP
13.4
TPSA (Topological Polar Surface Area)
108.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
38
Heavy Atoms
50
Complexity
826.0
Exact Mass
730.5989
Monoisotopic Mass
730.5989
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-Octadecanoylsphingosylphosphorylcholine

The XLogP value of 13.4 indicates that N-Octadecanoylsphingosylphosphorylcholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Octadecanoylsphingosylphosphorylcholine. Following Lipinski's Rule of Five, N-Octadecanoylsphingosylphosphorylcholine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of N-Octadecanoylsphingosylphosphorylcholine?

The CAS number of N-Octadecanoylsphingosylphosphorylcholine is 58909-84-5.

What is the molecular formula of N-Octadecanoylsphingosylphosphorylcholine?

The molecular formula of N-Octadecanoylsphingosylphosphorylcholine is C41H83N2O6P.

What is the molecular weight of N-Octadecanoylsphingosylphosphorylcholine?

The molecular weight of N-Octadecanoylsphingosylphosphorylcholine is 730.5989 g/mol.

What are the applications of N-Octadecanoylsphingosylphosphorylcholine?

N-Octadecanoylsphingosylphosphorylcholine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation...

Where can I buy N-Octadecanoylsphingosylphosphorylcholine?

You can request a quote for N-Octadecanoylsphingosylphosphorylcholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-Octadecanoylsphingosylphosphorylcholine?

Yes, CoreyChem provides custom synthesis services for N-Octadecanoylsphingosylphosphorylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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