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8YO : Summary
Code ![](/pdbe/static/images/help.png)
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8YO
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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-methoxy-1-benzofuran-2-carboxylic acid
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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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C10 H8 O4
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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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192.168 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 |
COc1cccc2cc(oc12)C(O)=O |
SMILES
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OpenEye OEToolkits |
2.0.6 |
COc1cccc2c1oc(c2)C(=O)O |
Canonical SMILES
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CACTVS |
3.385 |
COc1cccc2cc(oc12)C(O)=O |
Canonical SMILES
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OpenEye OEToolkits |
2.0.6 |
COc1cccc2c1oc(c2)C(=O)O |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C10H8O4/c1-13-7-4-2-3-6-5-8(10(11)12)14-9(6)7/h2-5H,1H3,(H,11,12) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | UOCNTRAAJNWDND-UHFFFAOYSA-N |
Is part of ![](/pdbe/static/images/help.png) |
8Z0
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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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2017-11-09
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Last modified at ![](/pdbe/static/images/help.png)
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2018-07-06
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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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