BGC > Product Search > Cucurbit[8]uril | 259886-51-6

WGKGermany: 3

Description :
Cucurbit[8]uril is a remarkably versatile host molecule utilized in a diverse range of drug delivery and catalysis applications. Its unique ability to selectively bind various drug and biomolecule targets with high avidity illustrates its significant potential as a candidate for targeted drug delivery. Furthermore, the catalytic efficacy and promising sensor properties of Cucurbit[8]uril make it a valuable asset in the field of chemical synthesis and detection of diverse analytes.

• Molecular Weight :1329.10
• Purity :95%

Molecular Formula :
C48H48N32O16
Canonical 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
InChI :
InChI=1S/C48H48N32O16/c81-33-49-1-50-18-20-54(34(50)82)4-58-22-24-62(38(58)86)8-66-26-28-70(42(66)90)12-74-30-32-78(46(74)94)15-77-31-29-73(45(77)93)11-69-27-25-65(41(69)89)7-61-23-21-57(37(61)85)3-53(33)19-17(49)51-2-52(18)36(84)56(20)6-60(22)40(88)64(24)10-68(26)44(92)72(28)14-76(30)48(96)80(32)16-79(31)47(95)75(29)13-71(27)43(91)67(25)9-63(23)39(87)59(21)5-55(19)35(51)83/h17-32H,1-16H2
InChIKey :
CONWISUOKHSUDR-UHFFFAOYSA-N
Appearance :
White Solid
Synonyms :
CB[8]; Cucurubituril(8)

More details are to be found here

Purity : 97%
Smile code : O=C1N2[C@](N3CN4[C@@]5([H])N(C(N6[C@@]5([H])N(CN7[C@@]8([H])N(C(N9[C@@]8([H])N(CN%10[C@@]%11([H])N(C(N%12[C@@]%11([H])N(CN(C%13=O)[C@@]%14([H])N(C(N%15CN%16C(N%17CN%18C(N%19CN%20C%21=O)=O)=O)=O)C%12)C%10=O)=O)C9)C7=O)=O)C6)C4=O)=O)C2)([H])[C@]%22([H])N1CN%21[C@@]([C@@]%20([H])N(CN%23[C@@]%19([H])[C@@]%18([H])N(CN%24[C@@]%17([H])[C@@]%16([H])N(CN%13[C@@]%14%15[H])C%24=O)C%23=O)C%25=O)([H])N%25CN%22C3=O
MDL Number : MFCD03456501
MolFormula : C48H48N32O16
MolWeight : 1329.0995
Available in stock : 20.743

More details are to be found here

Smile code:
O=C1N2[C@](N3CN4[C@@]5([H])N(C(N6[C@@]5([H])N(CN7[C@@]8([H])N(C(N9[C@@]8([H])N(CN%10[C@@]%11([H])N(C(N%12[C@@]%11([H])N(CN(C%13=O)[C@@]%14([H])N(C(N%15CN%16C(N%17CN%18C(N%19CN%20C%21=O)=O)=O)=O)C%12)C%10=O)=O)C9)C7=O)=O)C6)C4=O)=O)C2)([H])[C@]%22([H])N1CN%21[C@@]([C@@]%20([H])N(CN%23[C@@]%19([H])[C@@]%18([H])N(CN%24[C@@]%17([H])[C@@]%16([H])N(CN%13[C@@]%14%15[H])C%24=O)C%23=O)C%25=O)([H])N%25CN%22C3=O
MDL Number:
MFCD03456501
Purity :
97%
Available in stock:
27.943 g

More details are to be found here