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Dihydrochelerythrine

CAT: 0013-GTR19171312-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19171312-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Dihydrochelerythrine is a research compound with antifungal properties against plant pathogens and potential for treating Ichthyophthirius multifiliis infections. In vitro studies, such as in HL-60 cells, demonstrate its ability to induce apoptosis via mitochondrial pathways and disrupt the cell cycle.
CAS Number
6880-91-7
Product Name Alternative
Fungal, 12,13-Dihydrochelerythrine, antifungal, Dihydrochelerythrine
Field of Research
Infectious Disease & Virology
Purity
≥95% (May vary between batches)
Solubility
DMSO:10 mg/mL (28.62 mM)
Smiles
COc1ccc-2c (CN (C) c3c-2ccc2cc4OCOc4cc32) c1OC
Molecular Formula
C21H19NO4
Molecular Weight
349.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dihydrochelerythrine

Dihydrochelerythrine is a benzophenanthridine alkaloid.

CAS Number6880-91-7
PubChem CID485077
IUPAC Name1,2-dimethoxy-12-methyl-13H-[1,3]benzodioxolo[5,6-c]phenanthridine
Molecular FormulaC21H19NO4
Molecular Weight349.4
XLogP4.2
Topological Polar Surface Area40.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count26
Formal Charge0
Complexity516
SMILES
CN1CC2=C(C=CC(=C2OC)OC)C3=C1C4=CC5=C(C=C4C=C3)OCO5
InChI
InChI=1S/C21H19NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-9H,10-11H2,1-3H3
InChIKey
ALZAZMCIBRHMFF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dihydrochelerythrine
CAS: 6880-91-7
CID: 485077
Formula: C21H19NO4
MW: 349.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight349.4
XLogP34.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass349.13140809
Monoisotopic Mass349.13140809
Topological Polar Surface Area40.2 Ų
Heavy Atom Count26
Formal Charge0
Complexity516
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

Related Products

CatalogName
GTR19183862Bis (dihydrochelerythrinyl) amine

Alternative Products

CatalogName
AB2031Dihydrochelerythrine
HY-N103656- (1-Hydroxyethyl) -5,6-dihydrochelerythrine
MBS58249306-(1-Hydroxyethyl)-5,6-dihydrochelerythrine

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