Luteolin-7-O-glucoside

Luteolin-7-O-glucoside
Compound Structure:
Synonyms: 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one; Cynaroside; Luteoloside; Luteolin 7-glucoside; Cinaroside; Luteolin-7-glucoside; Luteolin 7-O-glucoside; Luteolin-7-O-glucoside
Compound ID: NMPC-1221
PubChem ID:

5280637
Molecular Formula: C21H20O11
Canonical SMILES: C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O
InChIKey: PEFNSGRTCBGNAN-QNDFHXLGSA-N
About the compound:

Luteolin 7-O-beta-D-glucoside is a glycosyloxyflavone that is luteolin substituted by a beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. It has a role as an antioxidant and a plant metabolite. It is a beta-D-glucoside, a glycosyloxyflavone, a trihydroxyflavone and a monosaccharide derivative. It is functionally related to a luteolin. It is a conjugate acid of a luteolin 7-O-beta-D-glucoside(1-).
Properties:

Chemical and Physical Properties

Property Name

Property Value

Molecular Weight

448.4 g/mol

XLogP3-AA

0.5

Hydrogen Bond Donor Count

7

Hydrogen Bond Acceptor Count

11

Rotatable Bond Count

4

Exact Mass

448.10056145 g/mol

Monoisotopic Mass

448.10056145 g/mol

Topological Polar Surface Area

186Ų

Heavy Atom Count

32

Formal Charge

0

Complexity

714

Isotope Atom Count

0

Defined Atom Stereocenter Count

5

Undefined Atom Stereocenter Count

0

Defined Bond Stereocenter Count

0

Undefined Bond Stereocenter Count

0

Covalently-Bonded Unit Count

1

Compound Is Canonicalized

Yes

Physical Description

Solid

Melting Point

256 - 258 °C

Source: PubChem            
Source Species: Sapium ellipticum
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