PHOME

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PHOME

PHOME | 1028430-42-3

Catelog Number A18-0065
Category Fluorescent Enzyme Substrates
Molecular Formula C23H19NO4
Molecular Weight 373.4
Catalog Number Size Price Quantity
A18-0065 -- $--

Product Introduction

PHOME is a fluorogenic substrate for human soluble epoxide hydrolase (sEH) that can be used to monitor the activity of sEH. PHOME is stable in aqueous solution and is useful in high throughput screening (HTS) programs.

Chemical Information

Synonyms 3-phenyl-cyano(6-methoxy-2-naphthalenyl)methyl ester-2-oxiraneacetic acid
Purity ≥98%
IUPAC Name [cyano-(6-methoxynaphthalen-2-yl)methyl] 2-(3-phenyloxiran-2-yl)acetate
Canonical SMILES COC1=CC2=C(C=C1)C=C(C=C2)C(C#N)OC(=O)CC3C(O3)C4=CC=CC=C4
InChI InChI=1S/C23H19NO4/c1-26-19-10-9-16-11-18(8-7-17(16)12-19)21(14-24)27-22(25)13-20-23(28-20)15-5-3-2-4-6-15/h2-12,20-21,23H,13H2,1H3
InChI Key NZOVBSWOWQLAJG-UHFFFAOYSA-N
Appearance Solid Powder

Product Specification

Storage Store at -20°C

Computed Properties

XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 373.13140809 g/mol
Monoisotopic Mass 373.13140809 g/mol
Topological Polar Surface Area 71.8Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 593
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Literatures

PMIDPublication DateTitleJournal
16729954 2006-08-01 Development of a high-throughput screen for soluble epoxide hydrolase inhibition Analytical biochemistry

Patents

Publication NumberTitlePriority Date
WO-2022267470-A1 Seh inhibitor or pharmaceutically acceptable composition thereof, and preparation method therefor and use thereof 2021-06-22
EP-4063348-A1 Compounds as soluble epoxide hydrolase inhibitors 2021-03-24
WO-2022200105-A1 Compounds as soluble epoxide hydrolase inhibitors 2021-03-24
WO-2020193448-A1 Multitarget compounds for the treatment of alzheimer's disease 2019-03-28
EP-3584236-A1 Polycyclic compounds soluble epoxide hydrolase inhibitors 2018-06-20
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