Nummularine B| CAS# 53947-96-9| analgesic

MedKoo Cat#: 581220 | Name: Nummularine B

Description:

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

Nummularine B is cyclopeptide alkaloids was isolated from the roots of Ziziphus jujuba. it has antiviral activity against the porcine epidemic diarrhea virus (PEDV) and potent inhibitory effects on PEDV replication.

Chemical Structure

Nummularine B

CAS#53947-96-9

Theoretical Analysis

MedKoo Cat#: 581220

Name: Nummularine B

CAS#: 53947-96-9

Chemical Formula: C32H43N5O6

Exact Mass: 593.3213

Molecular Weight: 593.73

Elemental Analysis: C, 64.74; H, 7.30; N, 11.80; O, 16.17

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

Nummularine B; Daechuine S27; N-Demethylamphibine H;

IUPAC/Chemical Name

Propanamide, 2-(methylamino)-N-(2-methyl-1-((3,3a,12,13,14,15,16,16a-octahydro-8-methoxy-13,16-dioxo-14-(phenylmethyl)-5,9-metheno-9H-pyrrolo(3,2-b)(1,5,8)oxadiazacyclopentadecin-1(2H)-yl)carbonyl)propyl)-

InChi Key

UCENISLVVUEBDB-FYWRMAATSA-N

InChi Code

InChI=1S/C32H43N5O6/c1-19(2)27(36-29(38)20(3)33-4)32(41)37-16-14-26-28(37)31(40)35-24(17-21-9-7-6-8-10-21)30(39)34-15-13-22-18-23(43-26)11-12-25(22)42-5/h6-13,15,19-20,22,24,26-28,33H,14,16-18H2,1-5H3,(H,34,39)(H,35,40)(H,36,38)/b15-13+

SMILES Code

CC(NC)C(NC(C(N1CCC(C1C(NC2CC3=CC=CC=C3)=O)OC(C4)=CC=C(OC)C4/C=C/NC2=O)=O)C(C)C)=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

>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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 593.73 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: Kang KB, Ming G, Kim GJ, Ha TK, Choi H, Oh WK, Sung SH. Jubanines F-J, cyclopeptide alkaloids from the roots of Ziziphus jujuba. Phytochemistry. 2015 Nov;119:90-5. doi: 10.1016/j.phytochem.2015.09.001. Epub 2015 Sep 8. PubMed PMID: 26361730. 2: Panseeta P, Lomchoey K, Prabpai S, Kongsaeree P, Suksamrarn A, Ruchirawat S, Suksamrarn S. Antiplasmodial and antimycobacterial cyclopeptide alkaloids from the root of Ziziphus mauritiana. Phytochemistry. 2011 Jun;72(9):909-15. doi: 10.1016/j.phytochem.2011.03.003. Epub 2011 Mar 28. PubMed PMID: 21450320. 3: Tuenter E, Foubert K, Staerk D, Apers S, Pieters L. Isolation and structure elucidation of cyclopeptide alkaloids from Ziziphus nummularia and Ziziphus spina-christi by HPLC-DAD-MS and HPLC-PDA-(HRMS)-SPE-NMR. Phytochemistry. 2017 Jun;138:163-169. doi: 10.1016/j.phytochem.2017.02.029. Epub 2017 Mar 8. PubMed PMID: 28284565.