MedKoo Cat#: 130526 | Name: SHP2 inhibitor CNBDA

Description:

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

SHP2 inhibitor CNBDA is a novel SHP2 inhibitor (IC50 of 5 μM). SHP2 inhibitor CNBDA has promising anti-breast cancer cell effects.

Chemical Structure

SHP2 inhibitor CNBDA
SHP2 inhibitor CNBDA
CAS#2101321-90-6

Theoretical Analysis

MedKoo Cat#: 130526

Name: SHP2 inhibitor CNBDA

CAS#: 2101321-90-6

Chemical Formula: C30H40O7

Exact Mass: 512.2774

Molecular Weight: 512.64

Elemental Analysis: C, 70.29; H, 7.87; O, 21.85

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
CNBDA, SHP2 In CNBDA, SHP2-In-CNBDA
IUPAC/Chemical Name
4,4'-(4'-Carboxy-4-(nonyloxy)-[1,1'-biphenyl]-3,5-diyl)dibutyric acid
InChi Key
GLVGBEAYRNBVMW-UHFFFAOYSA-N
InChi Code
InChI=1S/C30H40O7/c1-2-3-4-5-6-7-8-19-37-29-24(11-9-13-27(31)32)20-26(21-25(29)12-10-14-28(33)34)22-15-17-23(18-16-22)30(35)36/h15-18,20-21H,2-14,19H2,1H3,(H,31,32)(H,33,34)(H,35,36)
SMILES Code
CCCCCCCCCOC1=C(CCCC(O)=O)C=C(C2=CC=C(C(O)=O)C=C2)C=C1CCCC(O)=O
Appearance
To be determined
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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 512.64 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
1. Lade DM, Nicoletti R, Mersch J, Agazie YM. Design and synthesis of improved active-site SHP2 inhibitors with anti-breast cancer cell effects. Eur J Med Chem. 2023 Feb 5;247:115017. doi: 10.1016/j.ejmech.2022.115017. Epub 2022 Dec 12. PMID: 36584630. 2. Hartman Z, Geldenhuys WJ, Agazie YM. Novel Small-Molecule Inhibitor for the Oncogenic Tyrosine Phosphatase SHP2 with Anti-Breast Cancer Cell Effects. ACS Omega. 2020 Sep 25;5(39):25113-25124. doi: 10.1021/acsomega.0c02746. PMID: 33043190; PMCID: PMC7542598.