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Laricitrin 3-O-glucoside

CAT: 0804-HY-N7904-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N7904-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Laricitrin 3-O-glucoside is an antioxidant agent. Laricitrin 3-O-glucoside correlates significantly with DPPH assay and CUPRAC assay[1].
CAS Number
39986-90-8
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/laricitrin-3-o-glucoside.html
Solubility
10 mM in DMSO
Smiles
OC1=CC(C(OC2=CC(O)=CC(O)=C2C3=O)=C3O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO)=CC(OC)=C1O
Molecular Formula
C22H22O13
Molecular Weight
494.40
References & Citations
[1]Jiang B, et al. Comparison on phenolic compounds and antioxidant properties of cabernet sauvignon and merlot wines from four wine grape-growing regions in China. Molecules. 2012 Jul 25;17 (8) :8804-21.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Laricitrin 3-glucoside

Laricitrin 3-O-glucoside has been reported in Picea abies and Vitis vinifera with data available.

CAS Number39986-90-8
PubChem CID101682256
IUPAC Name2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-[(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=CC(=CC(=C1O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
InChI
InChI=1S/C22H22O13/c1-32-12-3-7(2-10(26)15(12)27)20-21(17(29)14-9(25)4-8(24)5-11(14)33-20)35-22-19(31)18(30)16(28)13(6-23)34-22/h2-5,13,16,18-19,22-28,30-31H,6H2,1H3/t13-,16-,18+,19-,22+/m1/s1
InChIKey
ODXINVOINFDDDD-CLXWZIMCSA-N
Chemical Structure
2D Structure
2D structure of Laricitrin 3-glucoside
CAS: 39986-90-8
CID: 101682256
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

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