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Patulitrin

CAT: 1410-M31900-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M31900-02Size:5 mg
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Description
Patulitrin has antioxidant, anti-inflammatory, and larvicidal activities, oral and topical administration of patuletin and patulitrin inhibited acute inflammation in mice.
CAS Number
19833-25-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
494.4
Molecular Formula
C22H22O13
Notes
Research use only, not for human use.
Receptor
——

Chemical Information

Patulitrin

Patulitrin is a glycoside and a member of flavonoids.

CAS Number19833-25-1
PubChem CID5320435
IUPAC Name2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC22H22O13
Molecular Weight494.4
XLogP0.3
Topological Polar Surface Area216
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Heavy Atom Count35
Formal Charge0
Complexity804
SMILES
COC1=C(C=C2C(=C1O)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI
InChI=1S/C22H22O13/c1-32-21-11(34-22-19(31)17(29)14(26)12(6-23)35-22)5-10-13(16(21)28)15(27)18(30)20(33-10)7-2-3-8(24)9(25)4-7/h2-5,12,14,17,19,22-26,28-31H,6H2,1H3/t12-,14-,17+,19-,22-/m1/s1
InChIKey
AFCDXKGLUDDXCK-LMTLLXHESA-N
Chemical Structure
2D Structure
2D structure of Patulitrin
CAS: 19833-25-1
CID: 5320435
Formula: C22H22O13
MW: 494.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight494.4
XLogP30.3
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count13
Rotatable Bond Count5
Exact Mass494.10604075
Monoisotopic Mass494.10604075
Topological Polar Surface Area216 Ų
Heavy Atom Count35
Formal Charge0
Complexity804
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA7931-.25Patulitrin

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