Swainsonine - ≥98% , CAS No.72741-87-8

CAS: 72741-87-8 Cat. No.: S130953 Molecular Weight: 173.21 Beilstein Registry Number: 4175740 EC Number: 615-797-6 PubChem CID: 51683

GRADE & PURITY ≥98%

Synonyms

CFCE4066-9132-492F-B4E1-B50B974FE148 | 1,2,8-Indolizinetriol, octahydro-, (1S,2R,8R,8aR)- | CAS-72741-87-8 | 1,2,8-Indolizinetriol, octahydro-, (1S-(1alpha,2alpha,8beta,8abeta))- | HY-N6722 | IDI1_002169 | SR-05000002325 | Tox21_112058 | 1,8-Indolizinetri

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

CFCE4066-9132-492F-B4E1-B50B974FE148 | 1, 2, 8-Indolizinetriol, octahydro-, (1S, 2R, 8R, 8aR)- | CAS-72741-87-8 | 1, 2, 8-Indolizinetriol, octahydro-, (1S-(1alpha, 2alpha, 8beta, 8abeta))- | HY-N6722 | IDI1_002169 | SR-05000002325 | Tox21_112058 | 1, 8-Indolizinetri

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Reversible lysosomal α-mannosidase inhibitor. Apoptotic agent. Induces apoptosis through mitochondrial pathway and caspase activation. Potentiates the effect of paclitaxel . Shows tremorgenic and ataxic effects in vivo. Orally active.

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.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1CC(C2C(C(CN2C1)O)O)O
• IUPAC Name: (1S,2R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2,8-triol
• InChIKey: FXUAIOOAOAVCGD-WCTZXXKLSA-N
• INCHI: 1S/C8H15NO3/c10-5-2-1-3-9-4-6(11)8(12)7(5)9/h5-8,10-12H,1-4H2/t5-,6-,7-,8-/m1/s1
• Isomeric SMILES: C1C[C@H]([C@@H]2[C@@H]([C@@H](CN2C1)O)O)O
• WGK Germany: 3
• RTECS: NM2408666
• PubChem CID: 51683
• Molecular Weight: 173.21
• Beilstein: 4175740

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Indolizidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Indolizidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Indolizidines
• Alternative Parents: Piperidines N-alkylpyrrolidines Trialkylamines Secondary alcohols 1,2-aminoalcohols Polyols Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Indolizidine - Piperidine - N-alkylpyrrolidine - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Polyol - Hydrocarbon derivative - Alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organopnictogen compound - Organic oxygen compound - Aliphatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as indolizidines. These are polycyclic compounds containing an indolizidine, which is a bicyclic heterocycle containing a saturated six-member ring fused to a saturated five-member ring, one of the bridging atoms being nitrogen.
• External Descriptors: Indolizidine alkaloids

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(Human)

MAN2B1 Tchem Lysosomal alpha-mannosidase (0 Activities)

Discover Target: MAN2B1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Chemical and Physical Properties

• Solubility: methanol: 5 mg/mL, clear, colorless to light yellow
• Sensitivity: Light sensitive;Moisture sensitive
• Molecular Weight: 173.210 g/mol
• XLogP3: -1.300
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 173.105 Da
• Monoisotopic Mass: 173.105 Da
• Topological Polar Surface Area: 63.900 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 176.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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