MedKoo Cat#: 463893 | Name: CAY10747

Description:

WARNING: This product is for research use only, not for human or veterinary use.

CAY10747 is an inhibitor of the protein-protein interaction between heat shock protein 90 (Hsp90) and cell division cycle 37 (Cdc37) and a derivative of celastrol. It decreases protein levels of the Hsp90-Cdc37 complex and the Hsp90-Cdc37 clients phosphorylated Akt and Cdk4 in A549 cells when used at a concentration of 5 µM. CAY10747 inhibits proliferation of A549, MCF-7, HOS, and HepG2 cells and induces apoptosis in A549 cells.

Chemical Structure

CAY10747
CAY10747
CAS#2413849-81-5

Theoretical Analysis

MedKoo Cat#: 463893

Name: CAY10747

CAS#: 2413849-81-5

Chemical Formula: C42H48FNO6

Exact Mass: 681.3466

Molecular Weight: 681.85

Elemental Analysis: C, 73.98; H, 7.10; F, 2.79; N, 2.05; O, 14.08

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Synonym
CAY10747; CAY 10747; CAY-10747;
IUPAC/Chemical Name
3-(((Z)-3-cyano-3-(4-fluorophenyl)acryloyl)oxy)propyl (2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicene-2-carboxylate
InChi Key
PNQKCDFOTMDGCU-PYZHFFOYSA-N
InChi Code
InChI=1S/C42H48FNO6/c1-26-30-12-13-33-40(4,31(30)23-32(45)36(26)47)17-19-42(6)34-24-39(3,15-14-38(34,2)16-18-41(33,42)5)37(48)50-21-7-20-49-35(46)22-28(25-44)27-8-10-29(43)11-9-27/h8-13,22-23,34,47H,7,14-21,24H2,1-6H3/b28-22+/t34-,38-,39-,40+,41-,42+/m1/s1
SMILES Code
O=C1C=C2C(C(C)=C1O)=CC=C3[C@@]2(C)CC[C@@]4(C)[C@@]5(C[C@@](C(OCCCOC(/C=C(C6=CC=C(C=C6)F)\C#N)=O)=O)(C)CC[C@]5(C)CC[C@]34C)[H]
Appearance
Solid powder
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
>2 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
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 681.85 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.

Recalculate based on batch purity %
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