N-[(E,2S,3R)-1,3-dihydroxyhexadec-4-en-2-yl]hexadecanamide

Base Information

• Chemical Name: N-[(E,2S,3R)-1,3-dihydroxyhexadec-4-en-2-yl]hexadecanamide
• CAS No.: 123065-37-2
• Molecular Formula: C32H63NO3
• Metabolomics Workbench ID: 87377
• Mol file: 123065-37-2.mol

Synonyms:123065-37-2;N-[(E,2S,3R)-1,3-dihydroxyhexadec-4-en-2-yl]hexadecanamide;N-[(1S,2R,3E)-2-hydroxy-1-(hydroxymethyl)-3-pentadecen-1-yl]-hexadecanamide;C16 Ceramide (d16:1/16:0);Cer(d16:1/16:0);Cer(d16:1(4E)/16:0);N-(hexadecanoyl)-4E-hexadecasphingenine

Chemical Property of N-[(E,2S,3R)-1,3-dihydroxyhexadec-4-en-2-yl]hexadecanamide

Chemical Property:

• XLogP3: 11.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 28
• Exact Mass: 509.48079487
• Heavy Atom Count: 36
• Complexity: 480

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)NC(CO)C(C=CCCCCCCCCCCC)O
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H](/C=C/CCCCCCCCCCC)O

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