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E6Q : Summary
Code ![](/pdbe/static/images/help.png)
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E6Q
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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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3-phenyl-1~{H}-pyrrolo[3,4-g]indol-8-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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C16 H10 N2 O
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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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246.263 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 |
O=C1N=Cc2ccc3c([nH]cc3c4ccccc4)c12 |
SMILES
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OpenEye OEToolkits |
2.0.6 |
c1ccc(cc1)c2c[nH]c3c2ccc4c3C(=O)N=C4 |
Canonical SMILES
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CACTVS |
3.385 |
O=C1N=Cc2ccc3c([nH]cc3c4ccccc4)c12 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.6 |
c1ccc(cc1)c2c[nH]c3c2ccc4c3C(=O)N=C4 |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C16H10N2O/c19-16-14-11(8-18-16)6-7-12-13(9-17-15(12)14)10-4-2-1-3-5-10/h1-9,17H |
IUPAC InChI key ![](/pdbe/static/images/help.png) | YJGNZVVUIPDSRL-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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29 (19 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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2018-02-21
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Last modified at ![](/pdbe/static/images/help.png)
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2018-05-11
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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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