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Hosenkoside K

CAT: 0804-HY-N2243-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-N2243-01Size:5 mg
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Description
Hosenkoside K is a baccharane glycoside isolated from the seeds of impatiens balsamina.
CAS Number
160896-49-1
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Applications
COVID-19-immunoregulation
Field of Research
Inflammation/Immunology
Assay Protocol
https://www.medchemexpress.com/Hosenkoside_K.html
Concentration
10mM
Purity
99.89
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
C[C@@]([C@@]1(CC[C@@]23CC[C@]([C@@H](C)CO[C@@H]([C@@H]([C@@H](O)[C@@H]4O)O)O[C@@H]4CO)([H])OC3)C)(CC[C@@]5([H])[C@]6(C)CO[C@@H]([C@@H]([C@@H](O)[C@@H]7O)O)O[C@@H]7CO)[C@@](CC[C@]1([H])[C@H]2O)([H])[C@]5(CC[C@@H]6O[C@@](O[C@H](CO)[C@@H](O)[C@@H]8O)([H])[C@@H]8O[C@]([C@@H]([C@@H](O)[C@@H]9O)O)([H])O[C@@H]9CO)C
Molecular Formula
C54H92O25
Molecular Weight
1141.29
References & Citations
[1]Yu X, et al. An LC-MS/MS method for simultaneous determination of hosenkoside A and hosenkoside K from Semen Impatientis in rat plasma and its application to a pharmacokinetic study. Biomed Chromatogr. 2017 Mar;31 (3) .
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Hosenkoside K

Hosenkoside K has been reported in Impatiens balsamina with data available.

CAS Number160896-49-1
PubChem CID102004887
IUPAC Name(2R,3R,4S,5S,6R)-2-[(2S)-2-[(1R,2S,2'S,4aR,4bR,6aR,7R,8S,10aR,10bR,12aS)-8-[(2R,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]oxy-1-hydroxy-4a,4b,7,10a-tetramethyl-7-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]spiro[3,4,5,6,6a,8,9,10,10b,11,12,12a-dodecahydro-1H-chrysene-2,5'-oxane]-2'-yl]propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC54H92O25
Molecular Weight1141.3
XLogP-1.4
Topological Polar Surface Area407
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count25
Rotatable Bond Count15
Heavy Atom Count79
Formal Charge0
Complexity2020
SMILES
C[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@H]2CC[C@@]3(CC[C@@]4([C@@H]([C@H]3O)CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CC[C@@H]([C@@]6(C)CO[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)C)C)C)CO2
InChI
InChI=1S/C54H92O25/c1-23(20-71-46-41(67)37(63)33(59)26(16-55)74-46)25-8-13-54(22-72-25)15-14-52(4)24(45(54)70)6-7-31-50(2)11-10-32(51(3,30(50)9-12-53(31,52)5)21-73-47-42(68)38(64)34(60)27(17-56)75-47)78-49-44(40(66)36(62)29(19-58)77-49)79-48-43(69)39(65)35(61)28(18-57)76-48/h23-49,55-70H,6-22H2,1-5H3/t23-,24+,25-,26+,27+,28+,29+,30+,31+,32-,33+,34+,35+,36+,37-,38-,39-,40-,41+,42+,43+,44+,45+,46+,47+,48-,49-,50-,51-,52+,53+,54+/m0/s1
InChIKey
JWINIHBXRZXFKL-SGBJXWCQSA-N
Chemical Structure
2D Structure
2D structure of Hosenkoside K
CAS: 160896-49-1
CID: 102004887
Formula: C54H92O25
MW: 1141.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight1141.3
XLogP3-1.4
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count25
Rotatable Bond Count15
Exact Mass1140.59276842
Monoisotopic Mass1140.59276842
Topological Polar Surface Area407 Ų
Heavy Atom Count79
Formal Charge0
Complexity2020
Isotope Atom Count0
Defined Atom Stereocenter Count32
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes