STOCK1N-65837 | CAS#N/A | modulator| MedKoo

MedKoo Cat#: 565609 | Name: STOCK1N-65837

Description:

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

STOCK1N-65837 is a potent natural modulator of human toll-like receptor 7 (tlr7)

Chemical Structure

STOCK1N-65837

CAS#N/A

Theoretical Analysis

MedKoo Cat#: 565609

Name: STOCK1N-65837

CAS#: N/A

Chemical Formula: C32H33N3O7

Exact Mass: 571.2319

Molecular Weight: 571.63

Elemental Analysis: C, 67.24; H, 5.82; N, 7.35; O, 19.59

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

STOCK1N-65837; STOCK1N 65837; STOCK1N65837

IUPAC/Chemical Name

(3a'S,6a'R)-3'-(3,4-Dihydroxybenzyl)-5'-(3,4-dimethoxyphenethyl)-5-ethyl-3',3a'-dihydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(5'H,6a'H)-trione

InChi Key

KJDQGMIITGVSAH-FLAMVOSXSA-N

InChi Code

InChI=1S/C32H33N3O7/c1-4-17-5-8-21-20(13-17)32(31(40)33-21)28-27(22(34-32)14-19-6-9-23(36)24(37)15-19)29(38)35(30(28)39)12-11-18-7-10-25(41-2)26(16-18)42-3/h5-10,13,15-16,22,27-28,34,36-37H,4,11-12,14H2,1-3H3,(H,33,40)/t22?,27-,28+,32?/m1/s1

SMILES Code

O=C1NC2=C(C=C(CC)C=C2)C13NC(CC4=CC=C(O)C(O)=C4)[C@]5([H])[C@@]3([H])C(N(CCC6=CC=C(OC)C(OC)=C6)C5=O)=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

More Info

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 571.63 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: Gupta CL, Babu Khan M, Ampasala DR, Akhtar S, Dwivedi UN, Bajpai P. Pharmacophore-based virtual screening approach for identification of potent natural modulatory compounds of human Toll-like receptor 7. J Biomol Struct Dyn. 2019 Jan 21:1-16. doi: 10.1080/07391102.2018.1559098. [Epub ahead of print] PubMed PMID: 30661449.