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N-Acetylphytosphingosine

CAT: 0804-HY-164263-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-164263-01Size:1 mg
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Description
N-Acetylphytosphingosine (NAPS) is a sphingolipid derivative. N-Acetylphytosphingosine induces mitochondria-dependent Apoptosis by activating Bak. N-Acetylphytosphingosine has antitumor activity[1].
CAS Number
21830-28-4
Product Name Alternative
NAPS
UNSPSC
12352211
Target
Apoptosis
Type
Reference compound
Related Pathways
Apoptosis
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/n-acetylphytosphingosine.html
Smiles
CCCCCCCCCCCCCC[C@@H](O)[C@@H](O)[C@H](CO)NC(C)=O
Molecular Formula
C20H41NO4
Molecular Weight
359.54
References & Citations
[1]Han Y, et al. N-acetylphytosphingosine-induced apoptosis of Jurkat cells is mediated by the conformational change in Bak. Apoptosis. 2006 Apr;11 (4) :581-8.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
Phase 3

Chemical Information

Phytosphingosine acetamide
CAS Number21830-28-4
PubChem CID9798946
IUPAC NameN-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]acetamide
Molecular FormulaC20H41NO4
Molecular Weight359.5
XLogP4.9
Topological Polar Surface Area89.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count17
Heavy Atom Count25
Formal Charge0
Complexity312
SMILES
CCCCCCCCCCCCCC[C@H]([C@H]([C@H](CO)NC(=O)C)O)O
InChI
InChI=1S/C20H41NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19(24)20(25)18(16-22)21-17(2)23/h18-20,22,24-25H,3-16H2,1-2H3,(H,21,23)/t18-,19+,20-/m0/s1
InChIKey
SZUJJDLBXJCDNT-ZCNNSNEGSA-N
Chemical Structure
2D Structure
2D structure of Phytosphingosine acetamide
CAS: 21830-28-4
CID: 9798946
Formula: C20H41NO4
MW: 359.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight359.5
XLogP34.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count4
Rotatable Bond Count17
Exact Mass359.30355879
Monoisotopic Mass359.30355879
Topological Polar Surface Area89.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity312
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes