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Soyasaponin Ba

CAT: 0013-GTR19165096-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165096-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Soyasaponin Ba shows promise as a vaccine adjuvant candidate due to its potent immunostimulatory activity and minimal hemolytic effects. Furthermore, Soyasaponins Ab and Bb have demonstrated in vivo efficacy by mitigating scopolamine-induced memory deficits in mice through a mechanism independent of acetylcholinesterase inhibition, highlighting their potential in neuroscience and immunology research.
CAS Number
114590-20-4
Product Name Alternative
CAMP, acetylcholinesterase, inhibit, Inhibitor, Soyasaponin Ba
Field of Research
Metabolism Research, Neuroscience
Purity
99.55% (May vary between batches)
Solubility
DMSO:9.6 mg/mL (10.01 mM)
Smiles
[H][C@@]1 (O[C@@H]2[C@@H] (O) [C@@H] (O) [C@@H] (CO) O[C@@]2 ([H]) O[C@@H]2[C@@H] (O) [C@H] (O) [C@H] (O[C@@]2 ([H]) O[C@H]2CC[C@@]3 (C) [C@@] ([H]) (CC[C@]4 (C) [C@]3 ([H]) CC=C3[C@]5 ([H]) CC (C) (C) C[C@@H] (O) [C@]5 (C) CC[C@@]43C) [C@@]2 (C) CO) C (O) =O) O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]1O
Molecular Formula
C48H78O19
Molecular Weight
959.12
Storage Conditions
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

Soyasaponin Ba

WFRQIKSNAYYUJZ-BKQVBUAGSA-N has been reported in Glycine max, Lotus pedunculatus, and other organisms with data available.

CAS Number114590-20-4
PubChem CID91973815
IUPAC Name(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,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-3,4-dihydroxyoxane-2-carboxylic acid
Molecular FormulaC48H78O19
Molecular Weight959.1
XLogP1.9
Topological Polar Surface Area315
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count19
Rotatable Bond Count10
Heavy Atom Count67
Formal Charge0
Complexity1840
SMILES
C[C@]12CC[C@@H]([C@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(C[C@H]5O)(C)C)C)C)C)(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O[C@H]7[C@@H]([C@H]([C@H]([C@H](O7)CO)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O
InChI
InChI=1S/C48H78O19/c1-43(2)16-22-21-8-9-26-45(4)12-11-28(46(5,20-51)25(45)10-13-48(26,7)47(21,6)15-14-44(22,3)27(52)17-43)64-42-38(34(58)33(57)36(65-42)39(60)61)67-41-37(32(56)30(54)24(19-50)63-41)66-40-35(59)31(55)29(53)23(18-49)62-40/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)/t22-,23+,24+,25+,26+,27+,28-,29+,30-,31-,32-,33-,34-,35+,36-,37+,38+,40-,41-,42+,44+,45-,46+,47+,48+/m0/s1
InChIKey
WFRQIKSNAYYUJZ-BKQVBUAGSA-N
Chemical Structure
2D Structure
2D structure of Soyasaponin Ba
CAS: 114590-20-4
CID: 91973815
Formula: C48H78O19
MW: 959.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight959.1
XLogP31.9
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count19
Rotatable Bond Count10
Exact Mass958.51373025
Monoisotopic Mass958.51373025
Topological Polar Surface Area315 Ų
Heavy Atom Count67
Formal Charge0
Complexity1840
Isotope Atom Count0
Defined Atom Stereocenter Count25
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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