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(+) -Viroallosecurinine

CAT: 0804-HY-N5002Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N5002Size:1 mg
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Description
(+) -Viroallosecurinine, a cytotoxic alkaloid, exhibits a MIC of 0.48 μg/mL for Ps. Aeruginosa and Staph. aureus[1]. Antibacterial activity[1].
CAS Number
1857-30-3
UNSPSC
12352005
Target
Bacterial
Type
Natural Products
Related Pathways
Anti-infection
Applications
COVID-19-immunoregulation
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/__addition__-Viroallosecurinine.html
Purity
99.0
Smiles
O=C(O1)C=C2[C@]13[C@](CCCC4)([H])N4[C@H](C3)C=C2
Molecular Formula
C13H15NO2
Molecular Weight
217.26
References & Citations
[1]Mensah JL, et al. Antibacterial activity of the leaves of Phyllanthus discoideus. J Ethnopharmacol. 1990 Feb;28 (1) :129-33.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Viroallosecurinine

Viroallosecurinine has been reported in Flueggea suffruticosa, Breynia coronata, and Flueggea virosa with data available.

CAS Number1857-30-3
PubChem CID908416
IUPAC Name(1R,2R,8R)-14-oxa-7-azatetracyclo[6.6.1.01,11.02,7]pentadeca-9,11-dien-13-one
Molecular FormulaC13H15NO2
Molecular Weight217.26
XLogP1.1
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count16
Formal Charge0
Complexity426
SMILES
C1CCN2[C@H](C1)[C@@]34C[C@@H]2C=CC3=CC(=O)O4
InChI
InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11+,13+/m0/s1
InChIKey
SWZMSZQQJRKFBP-DMDPSCGWSA-N
Chemical Structure
2D Structure
2D structure of Viroallosecurinine
CAS: 1857-30-3
CID: 908416
Formula: C13H15NO2
MW: 217.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight217.26
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass217.110278721
Monoisotopic Mass217.110278721
Topological Polar Surface Area29.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity426
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

Alternative Products

CatalogName
GTR19167228-01(+) -Viroallosecurinine
TBP03624Viroallosecurinine

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