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E0J : Summary
Code ![](/pdbe/static/images/help.png)
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E0J
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One-letter code ![](/pdbe/static/images/help.png)
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X
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Molecule name ![](/pdbe/static/images/help.png)
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2-[(4-methoxy-2-methylphenoxy)methyl]pyridine
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Systematic names ![](/pdbe/static/images/help.png)
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Formula ![](/pdbe/static/images/help.png)
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C14 H15 N O2
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Formal charge ![](/pdbe/static/images/help.png)
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0
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Molecular weight ![](/pdbe/static/images/help.png)
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229.274 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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ACDLabs |
12.01 |
c1(ccc(c(C)c1)OCc2ccccn2)OC |
SMILES
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CACTVS |
3.385 |
COc1ccc(OCc2ccccn2)c(C)c1 |
SMILES
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OpenEye OEToolkits |
2.0.6 |
Cc1cc(ccc1OCc2ccccn2)OC |
Canonical SMILES
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CACTVS |
3.385 |
COc1ccc(OCc2ccccn2)c(C)c1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.6 |
Cc1cc(ccc1OCc2ccccn2)OC |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C14H15NO2/c1-11-9-13(16-2)6-7-14(11)17-10-12-5-3-4-8-15-12/h3-9H,10H2,1-2H3 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | IJQMLIQZWDSRCW-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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32 (17 without Hydrogen)
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Polymer type ![](/pdbe/static/images/help.png)
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Bound ligand
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Type description ![](/pdbe/static/images/help.png)
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NON-POLYMER
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Type code ![](/pdbe/static/images/help.png)
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HETAIN
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Is modified ![](/pdbe/static/images/help.png)
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No
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Standard parent ![](/pdbe/static/images/help.png)
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Not Assigned
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Defined at ![](/pdbe/static/images/help.png)
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2017-11-20
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Last modified at ![](/pdbe/static/images/help.png)
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2018-08-31
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Status ![](/pdbe/static/images/help.png)
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Released
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Obsoleted ![](/pdbe/static/images/help.png)
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Not Assigned
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