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Sativanone

CAT: 0013-GTR19229298-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19229298-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Sativanone is a bioactive small molecule utilized in life sciences research. It serves as a valuable tool compound for investigating biological pathways in both in vitro assays and in vivo model studies, particularly within phytochemical and pharmacological research fields.
CAS Number
70561-31-8
Smiles
O=C1[C@@H] (COC=2C1=CC=C (O) C2) C3=C (OC) C=C (OC) C=C3
Molecular Formula
C17H16O5
Molecular Weight
300.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Sativanone

Sativanone is an ether and a member of flavonoids.

CAS Number70561-31-8
PubChem CID13886678
IUPAC Name3-(2,4-dimethoxyphenyl)-7-hydroxy-2,3-dihydrochromen-4-one
Molecular FormulaC17H16O5
Molecular Weight300.30
XLogP2.7
Topological Polar Surface Area65
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity399
SMILES
COC1=CC(=C(C=C1)C2COC3=C(C2=O)C=CC(=C3)O)OC
InChI
InChI=1S/C17H16O5/c1-20-11-4-6-12(15(8-11)21-2)14-9-22-16-7-10(18)3-5-13(16)17(14)19/h3-8,14,18H,9H2,1-2H3
InChIKey
JOVYBWHPTQRVNZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sativanone
CAS: 70561-31-8
CID: 13886678
Formula: C17H16O5
MW: 300.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight300.30
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass300.09977361
Monoisotopic Mass300.09977361
Topological Polar Surface Area65 Ų
Heavy Atom Count22
Formal Charge0
Complexity399
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

Alternative Products

CatalogName
HY-N15138-01Sativanone

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