A dual inhibitor of 5-LO and mPGES-1
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1-Naphthyl 3,5-dinitrobenzoate

Item No. 11729

Product Insert (PDF)Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
1-(3,5-dinitrobenzoate) 1-naphthalenol
CAS Number
93261-39-3
Synonyms
  • 1-(3,5-Dinitrobenzoyloxy)naphthalene
  • 1-Naphthalonol 3,5-dinitrobenzoate
Molecular Formula
C17H10N2O6
Formula Weight
338.3
Purity
≥98%
Formulation
A crystalline solid
Solubility(Learn about Variance in Solubility)
DMSO: .5 mg/ml*Methanol: .1 mg/ml*
λmax
221 nm
SMILES
O=C(C1=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C1)OC2=CC=CC3=C2C=CC=C3
InChi Code
InChI=1S/C17H10N2O6/c20-17(12-8-13(18(21)22)10-14(9-12)19(23)24)25-16-7-3-5-11-4-1-2-6-15(11)16/h1-10H
InChi Key
WYKPSINHJUWDHK-UHFFFAOYSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Wet ice in continental US; may vary elsewhere
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    1 mg

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    5 mg

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    10 mg

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    25 mg

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    Product Description

    1-Naphthyl 3,5-dinitrobenzoate has been identified as a dual 5-lipoxygenase and microsomal prostaglandin E synthase-1 inhibitor with IC50 values of 1 and 3.6 µM, respectively.1 The scaffold of this compound is being explored for anti-inflammatory drug design.1

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Wu, Y., He, C., Gao, Y., et al. Dynamic modeling of human 5-lipoxygenase-inhibitor interactions helps to discover novel inhibitors. J. Med. Chem. 55, 2597-2605 (2012).