D-erythro-sphinganine (C17 base) - Moligand™,≥99% , CAS No.32164-02-6

CAS: 32164-02-6 Cat. No.: D130696 Molecular Weight: 287.481

GRADE & PURITY Moligand™, ≥99%

Synonyms

CHEBI:137124 | sphinganine (d17:0), D-erythro-sphinganine (C17 base), powder | 1,3-Heptadecanediol, 2-amino-, (2S,3R)- | Sphinganine-C17 | AKOS040755258 | heptadecasphinganine | SCHEMBL16455713 | D-erythro-sphinganine (C17 base) | LMSP01040003 | (2S,3R)-2

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Sphinganine (d17:0), also referred to as dihydrosphingosine, is devoid of double bond. Decarboxylating condensation of serine with palmitoyl-CoA yield keto intermediate(2-oxosphinganine), which is then reduced by NADPH to form Sphinganine.
Sphinganine (d17:0) has been used in liquid chromatography-mass spectrometry (LC-MS) for the in-situ estimation of dihydrosphingosine utilization in N-(4-hydroxyphenyl)retinamide (4-HPR) resistant leukemia cells. It is suitable for use as an internal standard in metabolomic study.

Specifications

Synonyms

CHEBI:137124 | sphinganine (d17:0), D-erythro-sphinganine (C17 base), powder | 1, 3-Heptadecanediol, 2-amino-, (2S, 3R)- | Sphinganine-C17 | AKOS040755258 | heptadecasphinganine | SCHEMBL16455713 | D-erythro-sphinganine (C17 base) | LMSP01040003 | (2S, 3R)-2

Specifications & Purity

Moligand™, ≥99%

Biochemical and Physiological Mechanisms

Sphinganine (SPA) or D-erythro-sphinganine is involved in sphingolipid biosynthesis pathway.It acts as a precursor for ceramide.SPA has an ability to inhibit the activity of protein kinase c. SPA accumulation enables fumonisin B1 to stimulate apoptosis. I

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

INHIBITOR

Purity

≥99%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCCCC(C(CO)N)O
• IUPAC Name: (2S,3R)-2-aminoheptadecane-1,3-diol
• InChIKey: KFQUQCFJDMSIJF-DLBZAZTESA-N
• INCHI: 1S/C17H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(20)16(18)15-19/h16-17,19-20H,2-15,18H2,1H3/t16-,17+/m0/s1
• Isomeric SMILES: CCCCCCCCCCCCCC[C@H]([C@H](CO)N)O
• Molecular Weight: 287.481
• Reaxy-Rn: 38397694
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=38397694&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Secondary alcohols Primary alcohols Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - 1,2-aminoalcohol - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Primary alcohol - Organooxygen compound - Primary aliphatic amine - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 atom.
• External Descriptors: Sphingoid base homologs and variants

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

Candida albicans (78123 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 287.500 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 15
• Exact Mass: 287.282 Da
• Monoisotopic Mass: 287.282 Da
• Topological Polar Surface Area: 66.500 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 188.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1