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8SG : Summary
Code ![](/pdbe/static/images/help.png)
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8SG
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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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N-(3-methyl-1,2-oxazol-5-yl)furan-2-carboxamide
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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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C9 H8 N2 O3
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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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192.171 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 |
N(C(=O)c1ccco1)c2cc(C)no2 |
SMILES
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CACTVS |
3.385 |
Cc1cc(NC(=O)c2occc2)on1 |
SMILES
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OpenEye OEToolkits |
2.0.6 |
Cc1cc(on1)NC(=O)c2ccco2 |
Canonical SMILES
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CACTVS |
3.385 |
Cc1cc(NC(=O)c2occc2)on1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.6 |
Cc1cc(on1)NC(=O)c2ccco2 |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C9H8N2O3/c1-6-5-8(14-11-6)10-9(12)7-3-2-4-13-7/h2-5H,1H3,(H,10,12) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | DXEANZHOQJCTFV-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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22 (14 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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2017-03-03
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Last modified at ![](/pdbe/static/images/help.png)
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2017-03-10
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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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