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Hydrastinine

CAT: 0013-GTR19188875Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19188875Size:25 mg
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Description
Hydrastinine is a bioactive alkaloid isolated from Hydrastis canadensis (goldenseal) with established hemostatic properties. It is utilized in pharmacological research to study blood coagulation mechanisms, both in vitro and in animal models, for potential hemostatic applications.
CAS Number
6592-85-4
Smiles
CN1CCc2cc3OCOc3cc2C1O
Molecular Formula
C11H13NO3
Molecular Weight
207.229
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Hydrastinine

Hydrastinine is an organic molecular entity.

CAS Number6592-85-4
PubChem CID3638
IUPAC Name6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-ol
Molecular FormulaC11H13NO3
Molecular Weight207.23
XLogP1.1
Topological Polar Surface Area41.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity248
SMILES
CN1CCC2=CC3=C(C=C2C1O)OCO3
InChI
InChI=1S/C11H13NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h4-5,11,13H,2-3,6H2,1H3
InChIKey
YOJQZPVUNUQTDF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydrastinine
CAS: 6592-85-4
CID: 3638
Formula: C11H13NO3
MW: 207.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight207.23
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass207.08954328
Monoisotopic Mass207.08954328
Topological Polar Surface Area41.9 Ų
Heavy Atom Count15
Formal Charge0
Complexity248
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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