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N-Hexadecanoyl-alanine

CAT: 0024-sc-491891Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-491891Size:25 mg
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CAS Number
56255-31-3

Chemical Information

Palmitoyl Alanine

N-Palmitoyl alanine is a N-acyl-L-amino acid. It is a conjugate acid of a N-palmitoyl-L-alaninate.

CAS Number56255-31-3
PubChem CID14961184
IUPAC Name(2S)-2-(hexadecanoylamino)propanoic acid
Molecular FormulaC19H37NO3
Molecular Weight327.5
XLogP6.9
Topological Polar Surface Area66.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Heavy Atom Count23
Formal Charge0
Complexity305
SMILES
CCCCCCCCCCCCCCCC(=O)N[C@@H](C)C(=O)O
InChI
InChI=1S/C19H37NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(21)20-17(2)19(22)23/h17H,3-16H2,1-2H3,(H,20,21)(H,22,23)/t17-/m0/s1
InChIKey
NRBFOSKZAWRBJI-KRWDZBQOSA-N
Chemical Structure
2D Structure
2D structure of Palmitoyl Alanine
CAS: 56255-31-3
CID: 14961184
Formula: C19H37NO3
MW: 327.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight327.5
XLogP36.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count16
Exact Mass327.27734404
Monoisotopic Mass327.27734404
Topological Polar Surface Area66.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity305
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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GW6247-50mgN-Hexadecanoyl-L-homoserine lactone
MBS394963-01N-Hexadecanoyl-D-erythro-dihydrosphingosine
TRC-N252580-1GN-Hexadecanoyl-Valine Sodium Salt
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