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3-Ketosphingosine

CAT: 0804-HY-167820Size: 1 EachDry Ice: NoHazardous: No
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Description
3-Ketosphingosine is a chemically modified sphingomyelin analog with specific enzymatic pathway research activity. It is mainly used to explore the functions of sphingomyelin kinases and lyases in sphingomyelin metabolism. 3-Ketosphingosine has important application value in the study of cell signal transduction and related diseases. The study of 3-Ketosphingosine helps to deepen the understanding of sphingomyelin-related biological processes.
CAS Number
19767-16-9
UNSPSC
12352200
Target
Biochemical Assay Reagents
Type
Biochemical Assay Reagents
Related Pathways
Others
Assay Protocol
https://www.medchemexpress.com/3-ketosphingosine-trifluoroacetate.html
Smiles
CCCCCCCCCCCCC/C=C/C([C@@H](N)CO)=O
Molecular Formula
C18H35NO2
Molecular Weight
297.48
Shipping Conditions
Room temperature
Scientific Category
Biochemical Assay Reagents
Clinical Information
No Development Reported

Chemical Information

3-Ketosphingosine

3-dehydrosphingosine is a sphingoid that is the 3-keto analogue of sphingosine. It is an amino alcohol, a sphingoid, an enone and a beta-hydroxy ketone. It is functionally related to a sphingosine and a sphing-4-enine.

CAS Number19767-16-9
PubChem CID9839212
IUPAC Name(E,2S)-2-amino-1-hydroxyoctadec-4-en-3-one
Molecular FormulaC18H35NO2
Molecular Weight297.5
XLogP5.6
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Heavy Atom Count21
Formal Charge0
Complexity264
SMILES
CCCCCCCCCCCCC/C=C/C(=O)[C@H](CO)N
InChI
InChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17,20H,2-13,16,19H2,1H3/b15-14+/t17-/m0/s1
InChIKey
VWTPJNGTEYZXFV-ZWKQNVPVSA-N
Chemical Structure
2D Structure
2D structure of 3-Ketosphingosine
CAS: 19767-16-9
CID: 9839212
Formula: C18H35NO2
MW: 297.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight297.5
XLogP35.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count15
Exact Mass297.266779359
Monoisotopic Mass297.266779359
Topological Polar Surface Area63.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity264
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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sc-2235473-Ketosphingosine trifluoroacetate salt
465454-01S-3-Ketosphingosine Hydrochloride
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