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Flavamine

CAT: 0013-GTR19242496-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19242496-01Size:50 mg
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Description
Flavamine is a diterpenoid alkaloid of research interest. It serves as a biochemical tool for studying natural product biosynthesis and has been utilized in in vitro pharmacological investigations of alkaloid bioactivity.
CAS Number
15686-60-9
Smiles
O=C1C2=CC (=CC=C2OC (C=3C=CC=CC3) =C1C) CN (CC) CC
Molecular Formula
C21H23NO2
Molecular Weight
321.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Flavamine

Flavamine is a small molecule drug. Flavamine has a monoisotopic molecular weight of 321.17 Da.

CAS Number15686-60-9
PubChem CID27443
IUPAC Name6-(diethylaminomethyl)-3-methyl-2-phenylchromen-4-one
Molecular FormulaC21H23NO2
Molecular Weight321.4
XLogP4.5
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count24
Formal Charge0
Complexity474
SMILES
CCN(CC)CC1=CC2=C(C=C1)OC(=C(C2=O)C)C3=CC=CC=C3
InChI
InChI=1S/C21H23NO2/c1-4-22(5-2)14-16-11-12-19-18(13-16)20(23)15(3)21(24-19)17-9-7-6-8-10-17/h6-13H,4-5,14H2,1-3H3
InChIKey
LJVZNDLLRXZPNO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Flavamine
CAS: 15686-60-9
CID: 27443
Formula: C21H23NO2
MW: 321.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight321.4
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass321.172878976
Monoisotopic Mass321.172878976
Topological Polar Surface Area29.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity474
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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