Retusin

Compound Structure:

Synonyms:

Retusin ;1245-15-4 ;Quercetin-3,7,3',4'-tetramethyl ether ;Retusin (Ariocarpus); Retusine (Ariocarpus)

Compound ID:

NMPC-1451

PubChem ID:

5352005

Molecular Formula:

C19H18O7

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC)O)OC)OC

InChIKey:

HHGPYJLEJGNWJA-UHFFFAOYSA-N

About the compound:

5-hydroxy-3,3',4',7-tetramethoxyflavone is a monohydroxyflavone that is 5-hydroxyflavone which is substituted by methoxy groups at positions 3,3',4' and 7. It has a role as a plant metabolite. It is a tetramethoxyflavone, a member of 3'-methoxyflavones and a monohydroxyflavone. It is a conjugate acid of a 5-hydroxy-3,3',4',7-tetramethoxyflavone(1-).

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	358.3 g/mol
XLogP3-AA	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	358.10525291 g/mol
Monoisotopic Mass	358.10525291 g/mol
Topological Polar Surface Area	83.4Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	546
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source: PubChem

Source Species:

Talinum triangulare

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