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Kenposide B

CAT: 0013-GTR19223431-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223431-02Size:500 mg
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Description
Kenposide B is a fragrant glycoside compound isolated from the plant Hovenia dulcis. It is utilized in research areas such as phytochemistry and natural product studies, with investigations exploring its potential bioactivities in both in vitro and in vivo experimental models.
CAS Number
152468-89-8
Smiles
C/C (C) =C/CC (C (C) =C) COC1OC (C (C (C1O) O) O) COC2OCC (C (C2O) O) O
Molecular Formula
C21H36O10
Molecular Weight
448.50
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Kenposide B

Kenposide B is a terpene glycoside.

CAS Number152468-89-8
PubChem CID192589
IUPAC Name(2S,3S,4S,5S,6R)-2-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)-6-[[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxane-3,4,5-triol
Molecular FormulaC21H36O10
Molecular Weight448.5
XLogP-0.6
Topological Polar Surface Area158
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Heavy Atom Count31
Formal Charge0
Complexity607
SMILES
CC(=CCC(CO[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO[C@H]2[C@@H]([C@H]([C@H](CO2)O)O)O)O)O)O)C(=C)C)C
InChI
InChI=1S/C21H36O10/c1-10(2)5-6-12(11(3)4)7-28-21-19(27)17(25)16(24)14(31-21)9-30-20-18(26)15(23)13(22)8-29-20/h5,12-27H,3,6-9H2,1-2,4H3/t12?,13-,14+,15-,16+,17-,18+,19-,20-,21-/m0/s1
InChIKey
XOSSHORSTHFGFX-OMHAHRJWSA-N
Chemical Structure
2D Structure
2D structure of Kenposide B
CAS: 152468-89-8
CID: 192589
Formula: C21H36O10
MW: 448.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight448.5
XLogP3-0.6
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Exact Mass448.23084734
Monoisotopic Mass448.23084734
Topological Polar Surface Area158 Ų
Heavy Atom Count31
Formal Charge0
Complexity607
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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