MedKoo Cat#: 208369 | Name: SMIP-30

Description:

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

SMIP-30 is a small molecule inhibitor for PPM1A. SMIP-30 provides proof of concept that PPMs are druggable and promising targets for the development of host-directed therapies against tuberculosis.

Chemical Structure

SMIP-30
SMIP-30
CAS#2919466-30-9 (bromide)

Theoretical Analysis

MedKoo Cat#: 208369

Name: SMIP-30

CAS#: 2919466-30-9 (bromide)

Chemical Formula: C16H15BrFNO2

Exact Mass: 351.0270

Molecular Weight: 352.20

Elemental Analysis: C, 54.56; H, 4.29; Br, 22.69; F, 5.39; N, 3.98; O, 9.09

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 #
2919466-29-6 (cation) 2919466-30-9 (bromide)
Synonym
SMIP30, S-MIP-30
IUPAC/Chemical Name
2-Fluoro-5-(2-hydroxyethyl)-8-methoxyphenanthridin-5-ium bromide
InChi Key
ZBKGDGWEQRMRGD-UHFFFAOYSA-M
InChi Code
InChI=1S/C16H15FNO2.BrH/c1-20-13-3-4-14-11(8-13)10-18(6-7-19)16-5-2-12(17)9-15(14)16;/h2-5,8-10,19H,6-7H2,1H3;1H/q+1;/p-1
SMILES Code
COC1=CC=C2C(C=[N+](CCO)C3=C2C=C(F)C=C3)=C1.[Br-]
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 352.20 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
Berton S, Chen L, Liang YC, Xu Z, Afriyie-Asante A, Rajabalee N, Yang W, Sun J. A selective PPM1A inhibitor activates autophagy to restrict the survival of Mycobacterium tuberculosis. Cell Chem Biol. 2022 Jul 21;29(7):1126-1139.e12. doi: 10.1016/j.chembiol.2022.03.006. Epub 2022 Mar 22. PMID: 35320734. Liang YC, Berton S, Reeks C, Sun J. An in vivo biosafety-level-2-compatible model of Mycobacterium tuberculosis infection for drug susceptibility testing. STAR Protoc. 2022 Jul 19;3(3):101575. doi: 10.1016/j.xpro.2022.101575. PMID: 35880128; PMCID: PMC9307682.