Synonym
CAND1-Cullin1 destabilizer C60; CAND1 Cullin1 destabilizer C60; CAND1-Cullin1-destabilizer-C60
IUPAC/Chemical Name
Methyl 2-[[6-chloro-1-(4-methoxyphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbonyl]amino]benzoate
InChi Key
QKKLITDYULGDTP-UHFFFAOYSA-N
InChi Code
InChI=1S/C27H24ClN3O4/c1-34-18-10-7-16(8-11-18)25-24-19(21-15-17(28)9-12-23(21)29-24)13-14-31(25)27(33)30-22-6-4-3-5-20(22)26(32)35-2/h3-12,15,25,29H,13-14H2,1-2H3,(H,30,33)
SMILES Code
O=C(OC)C1=CC=CC=C1NC(N(C2C3=CC=C(OC)C=C3)CCC4=C2NC5=C4C=C(Cl)C=C5)=O
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>3 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
Preparing Stock Solutions
The following data is based on the
product
molecular weight
489.96
Batch specific molecular weights may vary
from batch to batch
due to the degree of hydration, which will
affect the solvent
volumes required to prepare stock solutions.
Concentration / Solvent Volume / Mass |
1 mg |
5 mg |
10 mg |
1 mM |
1.15 mL |
5.76 mL |
11.51 mL |
5 mM |
0.23 mL |
1.15 mL |
2.3 mL |
10 mM |
0.12 mL |
0.58 mL |
1.15 mL |
50 mM |
0.02 mL |
0.12 mL |
0.23 mL |
1: Bai C, Lin D, Mo Y, Lei J, Sun Y, Xie L, Yang X, Wei G. Influence of fullerenol on hIAPP aggregation: amyloid inhibition and mechanistic aspects. Phys Chem Chem Phys. 2019 Feb 13;21(7):4022-4031. doi: 10.1039/c8cp07501h. PubMed PMID: 30714593.
2: Suresh CH, Lincy TL, Mohan N, Rakhi R. Aromatization Energy and Strain Energy of Buckminsterfullerene from Homodesmotic Reactions. J Phys Chem A. 2015 Jun 25;119(25):6683-8. doi: 10.1021/acs.jpca.5b01157. Epub 2015 Jun 10. PubMed PMID: 26039030.
3: Sebastianelli F, Xu M, Bacić Z, Lawler R, Turro NJ. Hydrogen molecules inside fullerene C70: quantum dynamics, energetics, maximum occupancy, and comparison with C60. J Am Chem Soc. 2010 Jul 21;132(28):9826-32. doi: 10.1021/ja103062g. PubMed PMID: 20583809.
4: Alder RW, Harvey JN, Schleyer PR, Moran D. T(h)-symmetrical N8(C=C)6 and P8(C=C)6; an extraordinary contrast in heterofullerene stability. Org Lett. 2001 Oct 18;3(21):3233-6. PubMed PMID: 11594802.