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Shanziside

CAT: 0013-GTR19165481-05Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165481-05Size:25 mg
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Description
Shanzhiside is an immunosuppressive small molecule that potently inhibits IL-2 secretion in activated human peripheral blood T cells. This activity supports its research use in immunology for studying T-cell function and inflammation in both in vitro and in vivo experimental models.
CAS Number
29836-27-9
Product Name Alternative
Inhibit, Iridoid, ILReceptor, IL Receptor, Inhibitor, glucoside, Shanziside, Shanzhiside
Field of Research
Immunology & Inflammation
Purity
99.66% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:1 mg/mL (2.55 mM) ; DMSO:45 mg/mL (114.69 mM)
Smiles
[H][C@]12[C@H] (O) C[C@] (C) (O) [C@@]1 ([H]) [C@H] (O[C@]1 ([H]) O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]1O) OC=C2C (O) =O
Molecular Formula
C16H24O11
Molecular Weight
392.36
Storage Conditions
Keep away from moisture, store at low temperature | Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Shanzhiside

Shanzhiside is a terpene glycoside.

CAS Number29836-27-9
PubChem CID11948668
IUPAC Name(1S,4aS,5R,7S,7aS)-5,7-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid
Molecular FormulaC16H24O11
Molecular Weight392.35
XLogP-2.9
Topological Polar Surface Area186
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity609
SMILES
C[C@@]1(C[C@H]([C@H]2[C@@H]1[C@@H](OC=C2C(=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O
InChI
InChI=1S/C16H24O11/c1-16(24)2-6(18)8-5(13(22)23)4-25-14(9(8)16)27-15-12(21)11(20)10(19)7(3-17)26-15/h4,6-12,14-15,17-21,24H,2-3H2,1H3,(H,22,23)/t6-,7-,8+,9-,10-,11+,12-,14+,15+,16+/m1/s1
InChIKey
YSIFYNVXJOGADM-KDYWOABDSA-N
Chemical Structure
2D Structure
2D structure of Shanzhiside
CAS: 29836-27-9
CID: 11948668
Formula: C16H24O11
MW: 392.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight392.35
XLogP3-2.9
Hydrogen Bond Donor Count7
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass392.13186158
Monoisotopic Mass392.13186158
Topological Polar Surface Area186 Ų
Heavy Atom Count27
Formal Charge0
Complexity609
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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