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OVG : Summary
Code ![](/pdbe/static/images/help.png)
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OVG
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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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(6-butoxy-1-benzofuran-3-yl)acetic 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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C14 H16 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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248.274 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 |
C(=O)(O)Cc2coc1c2ccc(c1)OCCCC |
SMILES
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CACTVS |
3.385 |
CCCCOc1ccc2c(CC(O)=O)coc2c1 |
SMILES
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OpenEye OEToolkits |
2.0.7 |
CCCCOc1ccc2c(c1)occ2CC(=O)O |
Canonical SMILES
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CACTVS |
3.385 |
CCCCOc1ccc2c(CC(O)=O)coc2c1 |
Canonical SMILES
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OpenEye OEToolkits |
2.0.7 |
CCCCOc1ccc2c(c1)occ2CC(=O)O |
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IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C14H16O4/c1-2-3-6-17-11-4-5-12-10(7-14(15)16)9-18-13(12)8-11/h4-5,8-9H,2-3,6-7H2,1H3,(H,15,16) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | SZOTYOZQWWESFH-UHFFFAOYSA-N |
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wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
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34 (18 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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2019-07-09
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Last modified at ![](/pdbe/static/images/help.png)
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2019-11-01
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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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