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Meloside A

CAT: 0931-TN1921-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-TN1921-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
60767-80-8
Target
Others, ROS, Interleukin, Apoptosis, Androgen Receptor, TGF-beta/Smad
Related Pathways
Immunology/Inflammation, Others, Stem Cells, Apoptosis, Endocrinology/Hormones
Purity
0.9971
Bioactivity
Meloside A (Isovitexin 2''-O-β-D-glucoside) is a phenylpropanoid extracted from barley, exhibiting antioxidant and protective properties against excess UV-B radiation, and has been linked to resistance to pathogens.
Smiles
OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(cc(=O)c3c2O)-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Molecular Formula
C27H30O15
Molecular Weight
594.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

isovitexin 2''-O-glucoside

2''-O-(beta-D-glucosyl)isovitexin is a disaccharide derivative that is isovitexin substituted at position 2'' on the glucose ring by a beta-D-glucosyl residue. It has a role as a metabolite. It is a C-glycosyl compound, a trihydroxyflavone and a disaccharide derivative. It is functionally related to an isovitexin.

CAS Number60767-80-8
PubChem CID185995
IUPAC Name6-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
Molecular FormulaC27H30O15
Molecular Weight594.5
XLogP-1.4
Topological Polar Surface Area256
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count15
Rotatable Bond Count6
Heavy Atom Count42
Formal Charge0
Complexity971
SMILES
C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O
InChI
InChI=1S/C27H30O15/c28-7-15-20(34)23(37)26(42-27-24(38)22(36)19(33)16(8-29)41-27)25(40-15)18-12(32)6-14-17(21(18)35)11(31)5-13(39-14)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25+,26-,27+/m1/s1
InChIKey
RQTTXGQDIROLTQ-FASGCTRLSA-N
Chemical Structure
2D Structure
2D structure of isovitexin 2''-O-glucoside
CAS: 60767-80-8
CID: 185995
Formula: C27H30O15
MW: 594.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight594.5
XLogP3-1.4
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count15
Rotatable Bond Count6
Exact Mass594.15847025
Monoisotopic Mass594.15847025
Topological Polar Surface Area256 Ų
Heavy Atom Count42
Formal Charge0
Complexity971
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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