M-31850

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

MedKoo CAT#: 555368

CAS#: 281224-40-6

Description: M-31850 is a β-Hexosaminidase Inhibitor. M-31850 showed activity against the insect β-N-acetyl-D-hexosaminidase OfHex2. M-31850 acts as a substrate-competitive and selective inhibitor against human β-N-acetyl hexosaminidase (IC50 = 6.0 & 3.1 µM for hHex A & hHex B, respectively), while exhibiting much reduced potency against Jack Bean or bacterial Hex (IC50 = 280 & >500 µM for JBHex & SpHex, respectively) and little or no activity against SmHex or hOGN.


Chemical Structure

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M-31850
CAS# 281224-40-6

Theoretical Analysis

MedKoo Cat#: 555368
Name: M-31850
CAS#: 281224-40-6
Chemical Formula: C28H21N3O4
Exact Mass: 463.1532
Molecular Weight: 463.493
Elemental Analysis: C, 72.56; H, 4.57; N, 9.07; O, 13.81

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

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Synonym: M-31850; M 31850; M31850;

IUPAC/Chemical Name: 2,2'-(azanediylbis(ethane-2,1-diyl))bis(1H-benzo[de]isoquinoline-1,3(2H)-dione)

InChi Key: UPLUIYHKSADQOZ-UHFFFAOYSA-N

InChi Code: InChI=1S/C28H21N3O4/c32-25-19-9-1-5-17-6-2-10-20(23(17)19)26(33)30(25)15-13-29-14-16-31-27(34)21-11-3-7-18-8-4-12-22(24(18)21)28(31)35/h1-12,29H,13-16H2

SMILES Code: O=C(C1=CC=CC2=C1C3=CC=C2)N(CCNCCN(C4=O)C(C5=CC=CC6=C5C4=CC=C6)=O)C3=O

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: >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 463.493 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

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1: Liu T, Guo P, Zhou Y, Wang J, Chen L, Yang H, Qian X, Yang Q. A crystal
structure-guided rational design switching non-carbohydrate inhibitors'
specificity between two β-GlcNAcase homologs. Sci Rep. 2014 Aug 26;4:6188. doi:
10.1038/srep06188. PubMed PMID: 25155420; PubMed Central PMCID: PMC4143770.

2: Chen Q, Guo P, Xu L, Liu T, Qian X, Yang Q. Exploring unsymmetrical dyads as
efficient inhibitors against the insect β-N-acetyl-D-hexosaminidase OfHex2.
Biochimie. 2014 Feb;97:152-62. doi: 10.1016/j.biochi.2013.10.008. Epub 2013 Oct
17. PubMed PMID: 24140956.



Additional Information

The GH20 β-N-acetyl-d-hexosaminidase OfHex2 from the insect Ostrinia furnacalis (Guenée) is a target potential for eco-friendly pesticide development. Although carbohydrate-based inhibitors against β-N-acetyl-D-hexosaminidases are widely studied, highly efficient, non-carbohydrate inhibitors are more attractive due to low cost and readily synthetic manner.