(2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol 1-Phosphate

Base Information

• Chemical Name: (2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol 1-Phosphate
• CAS No.: 900499-41-4
• Molecular Formula: C15H32NO5P
• Molecular Weight: 337.39
• ChEMBL ID: CHEMBL199791
• Wikidata: Q76613784
• Mol file: 900499-41-4.mol

Synonyms:900499-41-4;CHEMBL199791;(2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol 1-Phosphate;[(E,2S,3R)-2-amino-3-hydroxypentadec-4-enyl] dihydrogen phosphate;(2S,3R,E)-2-Amino-3-hydroxypentadec-4-en-1-yl dihydrogen phosphate;starbld0009441;BDBM50475576

Chemical Property of (2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol 1-Phosphate

Chemical Property:

• PKA: 1.76±0.10(Predicted)
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 14
• Exact Mass: 337.20181012
• Heavy Atom Count: 22
• Complexity: 332

Purity/Quality:

99% ^*data from raw suppliers

(2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol1-Phosphate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCC=CC(C(COP(=O)(O)O)N)O
• Isomeric SMILES: CCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)(O)O)N)O
• Uses: (2S,3R,4E)-2-Amino-4-pentadecene-1,3-diol 1-Phosphate is a sphingosine derivative that was shown to exhibit inhibitory activities against Ca2+ ion mobilization in HL60 cells.

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