Products for Research Use Only

Parishin

CAT: 0013-GTR19169303-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19169303-03Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Parishin
CAS Number
62499-28-9
Product Name Alternative
Antiaging, Parishin, Parishin A, Inhibitor, lifespan, inhibit, glucoside, yeast, TOR, Sir2, phenolic, Uth1
Purity
98.56% (May vary between batches)
Solubility
DMSO:250 mg/mL (250.77 mM) ; Ethanol:Soluble;10% DMSO+40% PEG300+5% Tween 80+45% Saline:5 mg/mL (5.02 mM)
Smiles
OC[C@H]1O[C@@H] (Oc2ccc (COC (=O) CC (O) (CC (=O) OCc3ccc (O[C@@H]4O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]4O) cc3) C (=O) OCc3ccc (O[C@@H]4O[C@H] (CO) [C@@H] (O) [C@H] (O) [C@H]4O) cc3) cc2) [C@H] (O) [C@@H] (O) [C@@H]1O
Molecular Formula
C45H56O25
Molecular Weight
996.91
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Parishin A
CAS Number62499-28-9
PubChem CID10557926
IUPAC Nametris[[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl] 2-hydroxypropane-1,2,3-tricarboxylate
Molecular FormulaC45H56O25
Molecular Weight996.9
XLogP-3
Topological Polar Surface Area397
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count25
Rotatable Bond Count23
Heavy Atom Count70
Formal Charge0
Complexity1540
SMILES
C1=CC(=CC=C1COC(=O)CC(CC(=O)OCC2=CC=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)(C(=O)OCC4=CC=C(C=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O
InChI
InChI=1S/C45H56O25/c46-15-27-32(51)35(54)38(57)41(68-27)65-24-7-1-21(2-8-24)18-62-30(49)13-45(61,44(60)64-20-23-5-11-26(12-6-23)67-43-40(59)37(56)34(53)29(17-48)70-43)14-31(50)63-19-22-3-9-25(10-4-22)66-42-39(58)36(55)33(52)28(16-47)69-42/h1-12,27-29,32-43,46-48,51-59,61H,13-20H2/t27-,28-,29-,32-,33-,34-,35+,36+,37+,38-,39-,40-,41-,42-,43-/m1/s1
InChIKey
WYKQPGOKTKQHQG-SHGJSZTHSA-N
Chemical Structure
2D Structure
2D structure of Parishin A
CAS: 62499-28-9
CID: 10557926
Formula: C45H56O25
MW: 996.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight996.9
XLogP3-3
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count25
Rotatable Bond Count23
Exact Mass996.31106727
Monoisotopic Mass996.31106727
Topological Polar Surface Area397 Ų
Heavy Atom Count70
Formal Charge0
Complexity1540
Isotope Atom Count0
Defined Atom Stereocenter Count15
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes