Products for Research Use Only

Corydaline

CAT: 0013-GTR19168810-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168810-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Corydaline
CAS Number
518-69-4
Product Name Alternative
EV71, Enterovirus, HEV, HEVs, Inhibitor, HRVs, HRV, inhibit, oral, Opioid Receptor, OpioidReceptor, Corydalin, Corydaline, Cholinesterase (ChE), CYP2C9, CYP2C, COX-2, antinociceptive, antibutylcholinesterase, Antiacetylcholinesterase, antiallergic, (+) -Corydaline, AChE, Rhinovirus, Virus Protease, VirusProtease
Field of Research
Infectious Disease & Virology, Metabolism Research, Neuroscience, Pharmacology & Drug Discovery
Purity
98.01% (May vary between batches)
Solubility
DMSO:137.5 mg/mL (372.17 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.41 mM)
Smiles
COc1cc2CCN3Cc4c (ccc (OC) c4OC) C (C) C3c2cc1OC
Molecular Formula
C22H27NO4
Molecular Weight
369.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(+)-Corydaline

Corydaline is an isoquinoline alkaloid and a member of isoquinolines.

CAS Number518-69-4
PubChem CID101301
IUPAC Name(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline
Molecular FormulaC22H27NO4
Molecular Weight369.5
XLogP3.6
Topological Polar Surface Area40.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity503
SMILES
C[C@@H]1[C@@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)OC
InChI
InChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3/t13-,21+/m0/s1
InChIKey
VRSRXLJTYQVOHC-YEJXKQKISA-N
Chemical Structure
2D Structure
2D structure of (+)-Corydaline
CAS: 518-69-4
CID: 101301
Formula: C22H27NO4
MW: 369.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight369.5
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass369.19400834
Monoisotopic Mass369.19400834
Topological Polar Surface Area40.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity503
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes