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Indicaxanthin

CAT: 0804-HY-W747992Size: 1 EachDry Ice: NoHazardous: No
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Description
Indicaxanthin is a natural water-soluble betalain, presenting a yellow-orange color. Indicaxanthin possesses free radical scavenging ability and can inhibit lipid peroxidation, reducing the formation of malondialdehyde (MDA) . Indicaxanthin can be used in the research of cardiovascular diseases and diabetes[1].
CAS Number
2181-75-1
UNSPSC
12352005
Target
Endogenous Metabolite
Related Pathways
Metabolic Enzyme/Protease
Field of Research
Metabolic Disease; Cardiovascular Disease
Smiles
OC(C1=N[C@@H](CC(/C=C/N2CCC[C@H]2C(O)=O)=C1)C(O)=O)=O
Molecular Formula
C14H16N2O6
Molecular Weight
308.29
References & Citations
[1]Butera D, et al. Antioxidant activities of sicilian prickly pear (Opuntia ficus indica) fruit extracts and reducing properties of its betalains: betanin and indicaxanthin. J Agric Food Chem. 2002 Nov 6;50 (23) :6895-901.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Indicaxanthin

Indicaxanthin is a non-proteinogenic alpha-amino acid.

CAS Number2181-75-1
PubChem CID6096870
IUPAC Name(2S)-1-[(2E)-2-[(2S)-2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene]ethylidene]pyrrolidin-1-ium-2-carboxylate
Molecular FormulaC14H16N2O6
Molecular Weight308.29
XLogP0.4
Topological Polar Surface Area130
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity599
SMILES
C1C[C@H]([N+](=C/C=C/2\C[C@H](NC(=C2)C(=O)O)C(=O)O)C1)C(=O)[O-]
InChI
InChI=1S/C14H16N2O6/c17-12(18)9-6-8(7-10(15-9)13(19)20)3-5-16-4-1-2-11(16)14(21)22/h3,5-6,10-11H,1-2,4,7H2,(H3,17,18,19,20,21,22)/t10-,11-/m0/s1
InChIKey
RJIIQBYZGJSODH-QWRGUYRKSA-N
Chemical Structure
2D Structure
2D structure of Indicaxanthin
CAS: 2181-75-1
CID: 6096870
Formula: C14H16N2O6
MW: 308.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight308.29
XLogP30.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass308.10083623
Monoisotopic Mass308.10083623
Topological Polar Surface Area130 Ų
Heavy Atom Count22
Formal Charge0
Complexity599
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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