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Chemical structure of Cucurbit[8]uril

GC62913

Cucurbit[8]uril

Also known as 3,5,8,10,13,15,18,20,23,25,28,30,33,35,38,40,41,43,45,47,51,53,55,57,59,61,63,65,67,69,71,73-dotriacontazapentacosacyclo[35.3.3.36,7.311,12.316,17.321,22.326,27.331,32.22,41.236,43.13,40.15,8.110,13.115,18.120,23.125,28.130,33.135,38.145,51.147,73.153,55.157,59.161,63.165,67.169,71]octacontane-44,46,48,49,50,52,54,56,58,60,62,64,66,68,70,72-hexadecone

Cucurbit[8]uril is a potent, low toxicity and orally active supramolecular inducer of protein heterodimerization

ChemicalCAS259886-51-6MW1329.1FormulaC48H48N32O16
CAS number
259886-51-6
Molecular weight
1329.1
Formula
C48H48N32O16
Solubility
DMSO ： < 1 mg/mL (insoluble or slightly soluble)
InChIKey
CONWISUOKHSUDR-UHFFFAOYSA-N
Catalogue number
GC62913
Brand
GLPBIO
Computed properties PubChem CID 16133299 · XLogP -9.1 · TPSA 377 Ų · H-bond donors 0
XLogP
-9.1
TPSA
377 Ų
H-bond donors
0
H-bond acceptors
16
Rotatable bonds
0
Heavy atoms
96

SMILES C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)CN5C%13C%14N(C5=O)CN5C%15C%16N(C5=O)CN5C%17C(N1C5=O)N1CN3C(=O)N4CN6C(=O)N7CN9C(=O)N2CN8C(=O)N%10CN%11C(=O)N%12CN%13C(=O)N%14CN%15C(=O)N%16CN%17C1=O

Computed descriptors from PubChem (CID 16133299), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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