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Kouitchenside G

CAT: 0013-GTR19220233-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19220233-02Size:50 mg
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Description
Kouitchenside G is a natural α-glucosidase inhibitor isolated from Swertia kouitchensis, with a reported IC50 of 956 μM. This compound is a useful research tool for studying carbohydrate metabolism and for in vitro investigations related to diabetes management.
CAS Number
1444411-75-9
Field of Research
Metabolism Research
Smiles
O (C1=C2C (OC=3C (C2=O) =CC=CC3OC) =CC (OC) =C1) [C@@H]4O[C@H] (CO[C@@H]5O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]5O) [C@@H] (O) [C@H] (O) [C@H]4O
Molecular Formula
C27H32O15
Molecular Weight
596.53
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Kouitchenside G

Kouitchenside G has been reported in Swertia kouitchensis with data available.

CAS Number1444411-75-9
PubChem CID71745143
IUPAC Name3,5-dimethoxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyxanthen-9-one
Molecular FormulaC27H32O15
Molecular Weight596.5
XLogP-1.4
Topological Polar Surface Area223
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Heavy Atom Count42
Formal Charge0
Complexity909
SMILES
COC1=CC=CC2=C1OC3=C(C2=O)C(=CC(=C3)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O
InChI
InChI=1S/C27H32O15/c1-36-10-6-13-17(18(29)11-4-3-5-12(37-2)25(11)39-13)14(7-10)40-27-24(35)22(33)20(31)16(42-27)9-38-26-23(34)21(32)19(30)15(8-28)41-26/h3-7,15-16,19-24,26-28,30-35H,8-9H2,1-2H3/t15-,16-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1
InChIKey
MWYPCJMHTQFUAQ-YCPAWSGYSA-N
Chemical Structure
2D Structure
2D structure of Kouitchenside G
CAS: 1444411-75-9
CID: 71745143
Formula: C27H32O15
MW: 596.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight596.5
XLogP3-1.4
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass596.17412031
Monoisotopic Mass596.17412031
Topological Polar Surface Area223 Ų
Heavy Atom Count42
Formal Charge0
Complexity909
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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