Products for Research Use Only

Flazin

CAT: 0013-GTR19179009Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19179009Size:5 mg
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Description
Flazin (CAS 100041-05-2) is a small molecule compound for scientific research. It has been investigated in vitro for its biochemical properties and is utilized in life sciences research, including studies related to cellular processes and metabolic pathways.
CAS Number
100041-05-2
Field of Research
Immunology & Inflammation, Metabolism Research
Smiles
OCc1ccc (o1) -c1nc (cc2c3ccccc3[nH]c12) C (O) =O
Molecular Formula
C17H12N2O4
Molecular Weight
308.293
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Flazin

Flazin is a harmala alkaloid. It has a role as a metabolite.

CAS Number100041-05-2
PubChem CID5377686
IUPAC Name1-[5-(hydroxymethyl)furan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxylic acid
Molecular FormulaC17H12N2O4
Molecular Weight308.29
XLogP2.1
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity460
SMILES
C1=CC=C2C(=C1)C3=CC(=NC(=C3N2)C4=CC=C(O4)CO)C(=O)O
InChI
InChI=1S/C17H12N2O4/c20-8-9-5-6-14(23-9)16-15-11(7-13(19-16)17(21)22)10-3-1-2-4-12(10)18-15/h1-7,18,20H,8H2,(H,21,22)
InChIKey
USBWYUYKHHILLZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flazin
CAS: 100041-05-2
CID: 5377686
Formula: C17H12N2O4
MW: 308.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight308.29
XLogP32.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass308.07970687
Monoisotopic Mass308.07970687
Topological Polar Surface Area99.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity460
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

Alternative Products

CatalogName
MBS5788194Flazin