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nuezhenide

nuezhenide structure

CAS No:
39011-92-2
Formula:
C31H42O17
Chemical Name:
nuezhenide
Synonyms:
nuezhenide;Specnuezhenide;Nuezhenide2-(4-Hydroxyphenyl)ethyl-6-(3-ethylidene-2-(beta-D-glucopyranosyloxyl)-3,4-dihydro-5-(Methoxycarbonyl)-2H-pyran-4-acetate)-beta-D-glucopyranosidebeta-D-Glucopyranoside,2-(4-hydroxyphenyl)ethyl,6-(3-ethylidene-2-(beta-D-glucopyrano;Nuzhenide;Specnuezhenide(Nuezhenide)
Categories:
Natural Products > Iridoid Derivatives

Description

Specnuezhenide ((8E)-Nuezhenide) is isolated from the fruits of Ligustrum lucidum. Specnuezhenide ((8E)-Nuezhenide) can inhibit IL-1β-induced inflammation in chondrocytes via inhibition of NF-κB and wnt/β-catenin signaling. Specnuezhenide ((8E)-Nuezhenide) exerts anti-inflammatory effects in a rat model of osteoarthritis (OA)[1].

nuezhenide Basic Attributes

Molecular Weight：

686.65500

Exact Mass：

686.242188

HScode：

29389090

Characteristics

PSA：

260.59000

XLogP3：

-2.51560

Density：

1.5±0.1 g/cm3

Boiling Point：

893.8°C at 760 mmHg

Flash Point：

282.0±27.8 °C

Refractive Index：

1.636

Safety Information

safety instructions：

24/25

Drug Information

MeSH Entry Terms：

nuezhenide

Computed Properties

Molecular Weight:686.7
XLogP3:-2.2
Hydrogen Bond Donor Count:8
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:14
Exact Mass:686.24219987
Monoisotopic Mass:686.24219987
Topological Polar Surface Area:261
Heavy Atom Count:48
Complexity:1120
Defined Atom Stereocenter Count:12
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 39011-92-2

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Guide of nuezhenide

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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