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EJO : Summary
Code ![](/pdbe/static/images/help.png)
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EJO
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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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7-(diethylamino)chromen-2-one
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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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C13 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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217.264 Da
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SMILES ![](/pdbe/static/images/help.png)
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Type | Program | Version | Descriptor |
SMILES
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CACTVS |
3.385 |
CCN(CC)c1ccc2C=CC(=O)Oc2c1 |
SMILES
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OpenEye OEToolkits |
2.0.7 |
CCN(CC)c1ccc2c(c1)OC(=O)C=C2 |
Canonical SMILES
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CACTVS |
3.385 |
CCN(CC)c1ccc2C=CC(=O)Oc2c1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.7 |
CCN(CC)c1ccc2c(c1)OC(=O)C=C2 |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C13H15NO2/c1-3-14(4-2)11-7-5-10-6-8-13(15)16-12(10)9-11/h5-9H,3-4H2,1-2H3 |
IUPAC InChI key ![](/pdbe/static/images/help.png) | QXAMGWKESXGGNV-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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31 (16 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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2020-01-08
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Last modified at ![](/pdbe/static/images/help.png)
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2020-02-07
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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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