Products for Research Use Only

Jatrorrhizine

CAT: 0013-GTR19170626-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170626-02Size:5 mg
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Description
Jatrorrhizine (neprotin) is a protoberberine alkaloid derived from plants like Enantia chlorantha. It exhibits antimicrobial and antifungal properties and acts as a noncompetitive monoamine oxidase inhibitor (IC50 4 μM for MAO-A, 62 μM for MAO-B) . This compound is used in research on neurochemistry and infectious diseases in vitro.
CAS Number
3621-38-3
Product Name Alternative
Yatrorizine, quaternary isoquinoline, Serotonin Receptor, 5-hydroxytryptamine Receptor, 5HTReceptor, 5-HT Receptor, 5HT Receptor, AChE, alkaloid, Bacterial, antiplasmodial, antiamoebic, antidepressant, antidepressant-like, antioxidant, antimicrobial, Alzheimer's disease, Cholinesterase (ChE), depressive disorder, E. histolytica, Cytotoxic, inhibit, Jatrorrhizine, neuroprotective, neprotin, Inhibitor, MAO-A, MAO-B, falciparum
Field of Research
Infectious Disease & Virology, Metabolism Research, Neuroscience, Pharmacology & Drug Discovery
Purity
97.18% (May vary between batches)
Solubility
Chloroform, Dichloromethane, Ethyl Acetate, Acetone, etc.:Soluble; DMSO:6.67 mg/mL (19.71 mM)
Smiles
O (C) C=1C=C2C=3[N+] (=CC=4C (C3) =CC=C (OC) C4OC) CCC2=CC1O
Molecular Formula
C20H20NO4
Molecular Weight
338.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Jatrorrhizine

Jatrorrhizine is an alkaloid.

CAS Number3621-38-3
PubChem CID72323
IUPAC Name2,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-3-ol
Molecular FormulaC20H20NO4+
Molecular Weight338.4
XLogP3.4
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge1
Complexity461
SMILES
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)O)OC)OC
InChI
InChI=1S/C20H19NO4/c1-23-18-5-4-12-8-16-14-10-19(24-2)17(22)9-13(14)6-7-21(16)11-15(12)20(18)25-3/h4-5,8-11H,6-7H2,1-3H3/p+1
InChIKey
MXTLAHSTUOXGQF-UHFFFAOYSA-O
Chemical Structure
2D Structure
2D structure of Jatrorrhizine
CAS: 3621-38-3
CID: 72323
Formula: C20H20NO4+
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass338.13923312
Monoisotopic Mass338.13923312
Topological Polar Surface Area51.8 Ų
Heavy Atom Count25
Formal Charge1
Complexity461
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes