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Angustifoline (hydrochloride)

CAT: 0804-HY-N10087ASize: 1 EachDry Ice: NoHazardous: No
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Description
Angustifoline hydrochloride, an alkaloid, can be isolated from Lupinus angustifolius L. alkaloid extract. Angustifoline hydrochloride exhibits antimicrobial activity. Angustifoline hydrochloride could have bacteriostatic effects against S. aureus, B. subtilis, E. coli, P. aeruginosa and B. thuringiensis[1].
CAS Number
133398-34-2
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/angustifoline-hydrochloride.html
Solubility
10 mM in DMSO
Smiles
O=C1N2[C@]([C@](C3)([H])CN[C@@H](CC=C)[C@]3([H])C2)([H])CCC1.Cl
Molecular Formula
C14H23ClN2O
Molecular Weight
270.80
References & Citations
[1]Erdemoglu N, et al. Alkaloid profile and antimicrobial activity of Lupinus angustifolius L. alkaloid extract[J]. Phytochemistry reviews, 2007, 6 (1) : 197-201.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Angustifoline

angustifoline has been reported in Ormosia pinnata, Lupinus polyphyllus, and Lupinus albus with data available.

CAS Number133398-34-2
PubChem CID12306807
IUPAC Name(1S,2R,9S,10S)-10-prop-2-enyl-7,11-diazatricyclo[7.3.1.02,7]tridecan-6-one
Molecular FormulaC14H22N2O
Molecular Weight234.34
XLogP1.4
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity328
SMILES
C=CC[C@H]1[C@H]2C[C@@H](CN1)[C@H]3CCCC(=O)N3C2
InChI
InChI=1S/C14H22N2O/c1-2-4-12-11-7-10(8-15-12)13-5-3-6-14(17)16(13)9-11/h2,10-13,15H,1,3-9H2/t10-,11-,12-,13+/m0/s1
InChIKey
VTIPIBIDDZPDAV-ZDEQEGDKSA-N
Chemical Structure
2D Structure
2D structure of Angustifoline
CAS: 133398-34-2
CID: 12306807
Formula: C14H22N2O
MW: 234.34
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight234.34
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass234.173213330
Monoisotopic Mass234.173213330
Topological Polar Surface Area32.3 Ų
Heavy Atom Count17
Formal Charge0
Complexity328
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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