MedKoo Cat#: 124733 | Name: ROS inducer 1
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Description:

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

ROS inducer 1 (compound I29) is a fungicide, with EC50 against Xanthomonas axonopodis pv. citri (Xac), Xanthomonas oryzae pv. oryzae (Xoo), and Pseudomonas syringae pv. actinidiae (Psa)

Chemical Structure

ROS inducer 1
ROS inducer 1
CAS#2921602-31-3

Theoretical Analysis

MedKoo Cat#: 124733

Name: ROS inducer 1

CAS#: 2921602-31-3

Chemical Formula: C24H27FN4O

Exact Mass: 406.2169

Molecular Weight: 406.51

Elemental Analysis: C, 70.91; H, 6.70; F, 4.67; N, 13.78; O, 3.94

Price and Availability

Size Price Availability Quantity
100mg USD 750.00 2 Weeks
200mg USD 1,250.00 2 Weeks
500mg USD 2,650.00 2 Weeks
1g USD 3,650.00 2 Weeks
2g USD 5,650.00 2 Weeks
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Related CAS #
No Data
Synonym
ROS inducer 1; ROS inducer-1; ROS inducer1
IUPAC/Chemical Name
3-(4-(4-fluorophenyl)piperazin-1-yl)-1-(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)propan-1-one
InChi Key
RSIKPNFDYSSUMS-UHFFFAOYSA-N
InChi Code
InChI=1S/C24H27FN4O/c25-18-5-7-19(8-6-18)28-15-13-27(14-16-28)11-10-24(30)29-12-9-21-20-3-1-2-4-22(20)26-23(21)17-29/h1-8,26H,9-17H2
SMILES Code
FC(C=C1)=CC=C1N(CC2)CCN2CCC(N3CC4=C(C5=C(C=CC=C5)N4)CC3)=O
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 406.51 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
Liu HW, Su SS, Ma SY, Li T, Fang W, Ding Y, Liu ST, Zhang JR, Xiang HM, Zhou X, Yang S. Discovery and Structural Optimization of 1,2,3,4-Tetrahydro-β-carbolines as Novel Reactive Oxygen Species Inducers for Controlling Intractable Plant Bacterial Diseases. J Agric Food Chem. 2023 Jul 26;71(29):11035-11047. doi: 10.1021/acs.jafc.3c02615. Epub 2023 Jul 14. PMID: 37450840.