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Plantaginin

CAT: 0804-HY-N9925-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N9925-01Size:1 mg
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Description
Plantaginin is a glycoside can be isolated from fresh leaves of Plantago asiatica L.[1].
CAS Number
26046-94-6
Product Name Alternative
Scutellarein-7-O-glucoside
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/plantaginin.html
Purity
99.39
Solubility
10 mM in DMSO
Smiles
OC1=C2C(OC(C3=CC=C(C=C3)O)=CC2=O)=CC(O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO)=C1O
Molecular Formula
C21H20O11
Molecular Weight
448.38
Precautions
H302, H315, H319, H335
References & Citations
[1]NAKAOKI T, et al. [Studies on the medicinal resources. XX. Component of the leaves of Plantago asiatica L]. Yakugaku Zasshi. 1961 Dec;81:1697-9. Japanese.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Plantaginin

Plantaginin is a glycosyloxyflavone that is scutellarein attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has a role as a plant metabolite. It is a trihydroxyflavone, a glycosyloxyflavone and a monosaccharide derivative. It is functionally related to a scutellarein.

CAS Number26046-94-6
PubChem CID5320623
IUPAC Name5,6-dihydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC21H20O11
Molecular Weight448.4
XLogP0.5
Topological Polar Surface Area186
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity706
SMILES
C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O
InChI
InChI=1S/C21H20O11/c22-7-14-17(26)19(28)20(29)21(32-14)31-13-6-12-15(18(27)16(13)25)10(24)5-11(30-12)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21-/m1/s1
InChIKey
VUGRLRAUZWGZJP-IAAKTDFRSA-N
Chemical Structure
2D Structure
2D structure of Plantaginin
CAS: 26046-94-6
CID: 5320623
Formula: C21H20O11
MW: 448.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.4
XLogP30.5
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass448.10056145
Monoisotopic Mass448.10056145
Topological Polar Surface Area186 Ų
Heavy Atom Count32
Formal Charge0
Complexity706
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

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