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Corydamine

CAT: 0013-GTR19228930-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19228930-01Size:1 mg
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Description
Corydamine is a research chemical employed in life science studies. It serves as a useful tool compound for both in vitro biochemical assays and in vivo pharmacological research, particularly in investigations related to neurological and cardiovascular systems.
CAS Number
49870-84-0
Field of Research
Molecular Biology
Smiles
N1=CC2=C3OCOC3=CC=C2C=C1C=4C=C5OCOC5=CC4CCNC
Molecular Formula
C20H18N2O4
Molecular Weight
350.37
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Corydamine

Corydamine has been reported in Hypecoum erectum, Hypecoum leptocarpum, and other organisms with data available.

CAS Number49870-84-0
PubChem CID5316094
IUPAC Name2-[6-([1,3]dioxolo[4,5-h]isoquinolin-7-yl)-1,3-benzodioxol-5-yl]-N-methylethanamine
Molecular FormulaC20H18N2O4
Molecular Weight350.4
XLogP3.2
Topological Polar Surface Area61.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge0
Complexity492
SMILES
CNCCC1=CC2=C(C=C1C3=NC=C4C(=C3)C=CC5=C4OCO5)OCO2
InChI
InChI=1S/C20H18N2O4/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16-6-12-2-3-17-20(26-11-23-17)15(12)9-22-16/h2-3,6-9,21H,4-5,10-11H2,1H3
InChIKey
VWHAIQHZMVRBJN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Corydamine
CAS: 49870-84-0
CID: 5316094
Formula: C20H18N2O4
MW: 350.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight350.4
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass350.12665706
Monoisotopic Mass350.12665706
Topological Polar Surface Area61.8 Ų
Heavy Atom Count26
Formal Charge0
Complexity492
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

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