PubChem Compound Links for Structure (Select 91105) - PubChem Compound - NCBI

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Links from Structure

Items: 17

Select item 220028971.

an image of a chemical structure CID 22002897

1-(ethoxyethoxy)octane; SCHEMBL23391402; YDXZRYZRBMQYBK-UHFFFAOYSA-N

MW:: 202.330
MF:: C₁₂H₂₆O₂

IUPAC name:: 1-(2-ethoxyethoxy)octane

Create Date:: 2007-12-05

CID:: 22002897

Summary Same Parent, Connectivity

Select item 200960942.

an image of a chemical structure CID 20096094

MW:: 340.700
MF:: C₂₄H₅₂

IUPAC name:: dodecane

Create Date:: 2007-12-05

CID:: 20096094

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 187060403.

an image of a chemical structure CID 18706040

18854-46-1; DIETHYLENE GLYCOL ETHYL PENTYL ETHER; SCHEMBL2122442

MW:: 204.310
MF:: C₁₁H₂₄O₃

IUPAC name:: 1-[2-(2-ethoxyethoxy)ethoxy]pentane

Create Date:: 2007-12-04

CID:: 18706040

Summary Same Parent, Connectivity

Select item 27236924.

an image of a chemical structure CID 2723692

19327-38-9; Triethylene glycol monooctyl ether; 2-[2-(2-octoxyethoxy)ethoxy]ethanol ...

MW:: 262.390
MF:: C₁₄H₃₀O₄

IUPAC name:: 2-[2-(2-octoxyethoxy)ethoxy]ethanol

Create Date:: 2005-07-19

CID:: 2723692

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 27236915.

an image of a chemical structure CID 2723691

2-(2-octoxyethoxy)ethanol; 19327-37-8; 2-(2-Octyloxyethoxy)ethanol ...

MW:: 218.330
MF:: C₁₂H₂₆O₃

IUPAC name:: 2-(2-octoxyethoxy)ethanol

Create Date:: 2005-07-19

CID:: 2723691

Summary Same Parent, Connectivity

Select item 4459456.

an image of a chemical structure CID 445945

SCHEMBL23357179; MFCD00801422

MW:: 246.390
MF:: C₁₄H₃₀O₃

IUPAC name:: 1-[2-(2-ethoxyethoxy)ethoxy]octane

Create Date:: 2005-06-24

CID:: 445945

Summary Same Parent, Connectivity

Select item 4459447.

an image of a chemical structure CID 445944

MW:: 284.600
MF:: C₂₀H₄₄

IUPAC name:: nonane;undecane

Create Date:: 2005-06-24

CID:: 445944

Summary Mixture/Component Compounds

Select item 4455308.

an image of a chemical structure CID 445530

SCHEMBL14451911

MW:: 285.500
MF:: C₂₀H₃₁N

IUPAC name:: (2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl...

Create Date:: 2005-06-24

CID:: 445530

Summary Same Parent, Connectivity

Select item 4442799.

an image of a chemical structure CID 444279

1sqc; SCHEMBL13393807

MW:: 230.410
MF:: C₁₄H₃₂NO⁺

IUPAC name:: dodecyl-hydroxy-dimethylazanium

Create Date:: 2005-06-24

CID:: 444279

Summary Same Parent, Connectivity

Select item 44421010.

an image of a chemical structure CID 444210

Thiopalmitic Acid; 7530-93-0; hexadecanethioic S-acid ...

MW:: 272.500
MF:: C₁₆H₃₂OS

IUPAC name:: hexadecanethioic S-acid

Create Date:: 2005-06-24

CID:: 444210

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 43968011.

an image of a chemical structure CID 439680

beta-D-Mannopyranose; beta-D-Mannose; 7322-31-8 ...

MW:: 180.160
MF:: C₆H₁₂O₆

IUPAC name:: (2R,3S,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

Create Date:: 2005-06-23

CID:: 439680

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 43945412.

an image of a chemical structure CID 439454

18615-50-4; 2-acetamido-2-deoxy-beta-D-glucopyranosylamine; 4229-38-3 ...

MW:: 220.220
MF:: C₈H₁₆N₂O₅

IUPAC name:: N-[(2R,3R,4R,5S,6R)-2-amino-4,5-dihydroxy-6-(hydroxymethyl)o...

Create Date:: 2004-09-16

CID:: 439454

Summary Same Parent, Connectivity

Select item 8229613.

an image of a chemical structure CID 82296

2-(Octyloxy)ethanol; 10020-43-6; 2-octoxyethanol ...

MW:: 174.280
MF:: C₁₀H₂₂O₂

IUPAC name:: 2-octoxyethanol

Create Date:: 2005-03-27

CID:: 82296

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 7024714.

an image of a chemical structure CID 70247

1-Methoxyoctane; 929-56-6; Octane, 1-methoxy- ...

MW:: 144.250
MF:: C₉H₂₀O

IUPAC name:: 1-methoxyoctane

Create Date:: 2005-03-27

CID:: 70247

Summary Same Parent, Connectivity

Select item 3205115.

an image of a chemical structure CID 32051

zinc ion; zinc(2+); Zinc cation ...

MW:: 65.400
MF:: Zn⁺²

IUPAC name:: zinc(2+)

Create Date:: 2005-06-08

CID:: 32051

Summary Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 2413916.

an image of a chemical structure CID 24139

N-Acetyl-beta-D-glucosamine; acetylglucosamine; 2-acetamido-2-deoxy-beta-D-glucopyranose ...

MW:: 221.210
MF:: C₈H₁₅NO₆

IUPAC name:: N-[(2R,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3...

Create Date:: 2005-06-23

CID:: 24139

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 541417.

an image of a chemical structure CID 5414

19327-39-0; 3,6,9,12-tetraoxaicosan-1-ol; TETRAETHYLENE GLYCOL MONOOCTYL ETHER ...

MW:: 306.440
MF:: C₁₆H₃₄O₅

IUPAC name:: 2-[2-[2-(2-octoxyethoxy)ethoxy]ethoxy]ethanol

Create Date:: 2005-03-25

CID:: 5414

Summary Same Parent, Connectivity

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Chemical Properties

Rule of 5 (11)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

BioActivity Experiments

BioAssays, Active (2)
Compounds identified as active in screening experiments

BioAssays, Tested (3)
Compounds identified as tested in screening experiments

Protein 3D Structures (17)
Compounds bound to proteins in atructure biology experiments

BioMedical Annotation

Pharmacological Actions (1)
Therapeutic use and National Library of Medicine (NLM) compound classifications
BioSystems (3)
Compounds involved in biological pathways

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PubChem Compound Links for Structure (Select 91105) (17)
PubChem Compound
Taxonomy Links for Protein (Select 164606734) (1)
Taxonomy
Related DataSets for GEO Profiles (Select 12517021) (1)
GEO DataSets
Crohn disease and ulcerative colitis comparison
Crohn disease and ulcerative colitis comparison
Accession: GDS1330

GEO DataSets
Related DataSets for GEO Profiles (Select 12517574) (1)
GEO DataSets

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