D-Erythro-sphingosylphosphorylcholine supplier

Name
SPHINGOSYLPHOSPHORYLCHOLINE
EINECS
CAS No. 1670-26-4
Article Data4
CAS DataBase
Density
Solubility
Melting Point 90-102°C
Formula C₂₃H₄₉N₂O₅P
Boiling Point
Molecular Weight 464.626
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Choline,hydroxide, 2-amino-3-hydroxy-4-octadecenyl hydrogen phosphate, inner salt,(E)-D-erythro- (8CI);Ethanaminium,2-[[[(2-amino-3-hydroxy-4-octadecenyl)oxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-,inner salt, [R-[R*,S*-(E)]]-;Ethanaminium,2-[[[[(2S,3R,4E)-2-amino-3-hydroxy-4-octadecenyl]oxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl-,inner salt (9CI);C18-Sphingosine phosphocholine;Lysosphingomyelin;Sphingenyl-1-phosphorylcholine;Sphingosylphosphorylcholine;erythro-Sphingosylphosphorylcholine;
PSA 114.65000
LogP 5.91020

D-Erythro-sphingosylphosphorylcholine Specification

The D-Erythro-sphingosylphosphorylcholine, with the cas registry number 1670-26-4, has the systematic name of (2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 2-(trimethylammonio)ethyl phosphate. It is a kind of light yellow power, and should be stored at -20°C. And it belongs to the following product categories: Chemical Activators; Activators; Fatty Acid Derivatives & Lipids; Glycerols; Inhibitors; Protein Kinase Inhibitors and Activators. The molecular formula of the chemical is C₂₃H₄₉N₂O₅P.

The characteristics of this chemical are as followings: (1)ACD/LogP: 1.72; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 41; (6)ACD/BCF (pH 7.4): 216; (7)ACD/KOC (pH 5.5): 438; (8)ACD/KOC (pH 7.4): 2327; (9)#H bond acceptors: 7; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 23; (12)Polar Surface Area: 114.65 Å².

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N(CCC)CCCC
(2)InChI: InChI=1/C7H17N/c1-3-5-7-8-6-4-2/h8H,3-7H2,1-2H3
(3)InChIKey: CWYZDPHNAGSFQB-UHFFFAOYAU

Product Name

SPHINGOSYLPHOSPHORYLCHOLINE

D-Erythro-sphingosylphosphorylcholine Specification

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