Orientin

Compound Structure:

Synonyms:

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one; Orientin; Lutexin; Luteolin-8-glucoside; Luteolin 8-C-glucoside; Orientine; Luteolin 8-glucoside; 8-beta-D-glucosylluteolin

Compound ID:

NMPC-1362

PubChem ID:

5281675

Molecular Formula:

C21H20O11

Canonical SMILES:

C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O)O

InChIKey:

PLAPMLGJVGLZOV-VPRICQMDSA-N

About the compound:

Orientin is a C-glycosyl compound that is luteolin substituted by a beta-D-glucopyranosyl moiety at position 8. It has a role as an antioxidant and a metabolite. It is a C-glycosyl compound, a tetrahydroxyflavone and a 3'-hydroxyflavonoid. It is functionally related to a luteolin.

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	448.4 g/mol
XLogP3-AA	-0.2
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	11
Rotatable Bond Count	3
Exact Mass	448.10056145 g/mol
Monoisotopic Mass	448.10056145 g/mol
Topological Polar Surface Area	197Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	729
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

Source: PubChem

Source Species:

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