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Tectochrysin

CAT: 0926-FT66186-03Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-FT66186-03Size:250 mg
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CAS Number
520-28-5
Synonyms
5-Hydroxy-7-methoxyflavone; Methyl chrysin; Chrysin 7-methylether
MDL Number
MFCD00016945
Smiles
COC1=CC (=C2C (=C1) OC (=CC2=O) C3=CC=CC=C3) O
Molecular Formula
C16H12O4
Molecular Weight
268.26 g/mol
Controlled
No

Chemical Information

Tectochrysin

Tectochrysin is a monohydroxyflavone that is flavone substituted by a hydroxy group at position 4 and a methoxy group at position 7 respectively. It has a role as an antineoplastic agent, an antidiarrhoeal drug and a plant metabolite. It is a monomethoxyflavone and a monohydroxyflavone. It is functionally related to a flavone.

CAS Number520-28-5
PubChem CID5281954
IUPAC Name5-hydroxy-7-methoxy-2-phenylchromen-4-one
Molecular FormulaC16H12O4
Molecular Weight268.26
XLogP2.4
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity397
SMILES
COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=CC=C3)O
InChI
InChI=1S/C16H12O4/c1-19-11-7-12(17)16-13(18)9-14(20-15(16)8-11)10-5-3-2-4-6-10/h2-9,17H,1H3
InChIKey
IRZVHDLBAYNPCT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tectochrysin
CAS: 520-28-5
CID: 5281954
Formula: C16H12O4
MW: 268.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight268.26
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass268.07355886
Monoisotopic Mass268.07355886
Topological Polar Surface Area55.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity397
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