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Thermopsoside

CAT: 0013-GTR19189122-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189122-01Size:1 mg
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Description
This research-grade small molecule, Chrysoeriol-7-O-glucoside, is a potent inhibitor of the complement system's classical pathway. It is also studied for its role in modulating lipid metabolism, including the inhibition of intestinal fatty acid uptake and the enhancement of lipolysis in adipocytes in vitro.
CAS Number
19993-32-9
Field of Research
Metabolism Research
Purity
99.17% (May vary between batches)
Smiles
O=C1C=2C (OC (=C1) C3=CC (OC) =C (O) C=C3) =CC (O[C@@H]4O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]4O) =CC2O
Molecular Formula
C22H22O11
Molecular Weight
462.4
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

7-O-Beta-D-Glucopyranoside

Chrysoeriol 7-O-glucoside has been reported in Hyparrhenia hirta, Itoa orientalis, and other organisms with data available.

CAS Number19993-32-9
PubChem CID11294177
IUPAC Name5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Molecular FormulaC22H22O11
Molecular Weight462.4
XLogP0.8
Topological Polar Surface Area175
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity729
SMILES
COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
InChI
InChI=1S/C22H22O11/c1-30-15-4-9(2-3-11(15)24)14-7-13(26)18-12(25)5-10(6-16(18)32-14)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1
InChIKey
GAMYVSCDDLXAQW-MIUGBVLSSA-N
Chemical Structure
2D Structure
2D structure of 7-O-Beta-D-Glucopyranoside
CAS: 19993-32-9
CID: 11294177
Formula: C22H22O11
MW: 462.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight462.4
XLogP30.8
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Exact Mass462.11621151
Monoisotopic Mass462.11621151
Topological Polar Surface Area175 Ų
Heavy Atom Count33
Formal Charge0
Complexity729
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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