LY52 | CAS#769970-91-4 | metalloproteinase-2 inhibitor

MedKoo Cat#: 563201 | Name: LY52

Description:

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

LY52 is an inhibitor of matrix metalloproteinase-2. It acts by suppressing tumor invasion and metastasis.

Chemical Structure

LY52

CAS#769970-91-4

Theoretical Analysis

MedKoo Cat#: 563201

Name: LY52

CAS#: 769970-91-4

Chemical Formula: C22H24N4O6

Exact Mass: 440.1696

Molecular Weight: 440.45

Elemental Analysis: C, 59.99; H, 5.49; N, 12.72; O, 21.79

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.

Bulk Inquiry

Related CAS #

No Data

Synonym

LY52; LY-52; LY 52;

IUPAC/Chemical Name

N-[(3S,5S)-1-[(2E)-3-(3,4-Dimethoxyphenyl)-1-oxo-2-propen-1-yl]-5-[(hydroxyamino)carbonyl]-3-pyrrolidinyl]-3-pyridinecarboxamide

InChi Key

AKOSAZUQCGCWJD-IWDGFTLQSA-N

InChi Code

InChI=1S/C22H24N4O6/c1-31-18-7-5-14(10-19(18)32-2)6-8-20(27)26-13-16(11-17(26)22(29)25-30)24-21(28)15-4-3-9-23-12-15/h3-10,12,16-17,30H,11,13H2,1-2H3,(H,24,28)(H,25,29)/b8-6+/t16-,17-/m0/s1

SMILES Code

O=C(C1=CC=CN=C1)N[C@@H]2CN(C(/C=C/C3=CC=C(OC)C(OC)=C3)=O)[C@H](C(NO)=O)C2

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

2934.99.03.00

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 440.45 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: Zhang H, Li X, Wang X, Xu W, Zhang J. Sulfonyl phosphonic 1,4-dithia-7-azaspiro[4,4]nonane derivatives as matrix metalloproteinase inhibitors: Synthesis, a docking study, and biological evaluation. Drug Discov Ther. 2017;11(3):118-125. doi: 10.5582/ddt.2017.01016. PubMed PMID: 28757512. 2: Yang L, Wang P, Wu JF, Yang LM, Wang RR, Pang W, Li YG, Shen YM, Zheng YT, Li X. Design, synthesis and anti-HIV-1 evaluation of hydrazide-based peptidomimetics as selective gelatinase inhibitors. Bioorg Med Chem. 2016 May 1;24(9):2125-36. doi: 10.1016/j.bmc.2016.03.043. Epub 2016 Mar 26. PubMed PMID: 27039251. 3: Zhang J, Li X, Jiang Y, Feng J, Li X, Zhang Y, Xu W. Design, synthesis and preliminary evaluation of α-sulfonyl γ-(glycinyl-amino)proline peptidomimetics as matrix metalloproteinase inhibitors. Bioorg Med Chem. 2014 Jun 1;22(11):3055-64. doi: 10.1016/j.bmc.2013.12.025. Epub 2013 Dec 21. PubMed PMID: 24755524. 4: Shi L, Wang Q, Wang H, Zhou H, Li Y, Li X. Sulphonamide 1,4-dithia-7-azaspiro[4,4]nonane derivatives as gelatinase A inhibitors. Bioorg Med Chem. 2013 Dec 15;21(24):7752-62. doi: 10.1016/j.bmc.2013.10.016. Epub 2013 Oct 30. PubMed PMID: 24247003. 5: Zhao X, Xu H, Inagaki Y, Kokudo N, Xu W, Dong J, Tang W. Caffeoyl pyrrolidine derivative LY52 inhibits hepatocellular carcinoma invasion via suppressing matrix metalloproteinase-2. Hepatol Int. 2011 Jun;5(2):716-21. doi: 10.1007/s12072-010-9234-y. Epub 2010 Dec 21. PubMed PMID: 21484106; PubMed Central PMCID: PMC3090555. 6: Zhang J, Li X, Zhu HW, Wang Q, Feng JH, Mou JJ, Li YG, Fang H, Xu WF. Design, synthesis, and primary activity evaluation of pyrrolidine derivatives as matrix metalloproteinase inhibitors. Drug Discov Ther. 2010 Feb;4(1):5-12. PubMed PMID: 22491146. 7: Li Y, Zhang J, Xu W, Zhu H, Li X. Novel matrix metalloproteinase inhibitors derived from quinoxalinone scaffold (Part I). Bioorg Med Chem. 2010 Feb 15;18(4):1516-25. doi: 10.1016/j.bmc.2010.01.008. Epub 2010 Jan 11. PubMed PMID: 20097082. 8: Cheng XC, Wang Q, Fang H, Tang W, Xu WF. Synthesis of new sulfonyl pyrrolidine derivatives as matrix metalloproteinase inhibitors. Bioorg Med Chem. 2008 Sep 1;16(17):7932-8. doi: 10.1016/j.bmc.2008.07.073. Epub 2008 Jul 30. PubMed PMID: 18718763. 9: Cheng XC, Wang Q, Fang H, Tang W, Xu WF. Design, synthesis and evaluation of novel sulfonyl pyrrolidine derivatives as matrix metalloproteinase inhibitors. Bioorg Med Chem. 2008 May 15;16(10):5398-404. doi: 10.1016/j.bmc.2008.04.027. Epub 2008 Apr 15. PubMed PMID: 18440232. 10: Cheng XC, Wang Q, Fang H, Tang W, Xu WF. Design, synthesis and preliminary evaluation of novel pyrrolidine derivatives as matrix metalloproteinase inhibitors. Eur J Med Chem. 2008 Oct;43(10):2130-9. doi: 10.1016/j.ejmech.2007.12.020. Epub 2007 Dec 31. PubMed PMID: 18362041. 11: Qu X, Yuan Y, Xu W, Chen M, Cui S, Meng H, Li Y, Makuuchi M, Nakata M, Tang W. Caffeoyl pyrrolidine derivative LY52 inhibits tumor invasion and metastasis via suppression of matrix metalloproteinase activity. Anticancer Res. 2006 Sep-Oct;26(5A):3573-8. PubMed PMID: 17094485. 12: Qu XJ, Yuan YX, Tian ZG, Xu WF, Chen MH, Cui SX, Guo Q, Gai R, Makuuchi M, Nakata M, Tang W. Using caffeoyl pyrrolidine derivative LY52, a potential inhibitor of matrix metalloproteinase-2, to suppress tumor invasion and metastasis. Int J Mol Med. 2006 Oct;18(4):609-14. PubMed PMID: 16964412. 13: Yuan YX, Xu WF, Liu J, Chen MH, Meng H, Qu XJ. [Inhibitory effects of matrix metalloproteinase (MMP) inhibitor LY52 on expression of MMP-2 and MMP-9 and invasive ability of human ovarian carcinoma cell line SKOV3]. Ai Zheng. 2006 Jun;25(6):663-70. Chinese. PubMed PMID: 16764758.