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<table align='right' border=1><tr><td><jmol><jmolApplet><size>200</size><script>spin on;color atoms amino;</script><uploadedFileContents>124905.SDF</uploadedFileContents><color>black</color></jmolApplet></jmol></td></tr></table>
[http://crdd.osdd.net/raghava/biadb/str.php?id=124905&show=SHOW-3D Show 3-D Structure]

[http://crdd.osdd.net/raghava/biadb/str.php?id=124905&show=SHOW-2D Show 2-D Structure]

{{Drugbox
| IUPAC_name        =1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydroisoquinoline;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
| PubChem           = 124905
| DrugBank          =
| ChemSpiderID      =
| chemical_formula  =C<sub>3</sub><sub>3</sub>H<sub>4</sub><sub>1</sub>N<sub>5</sub>O<sub>8</sub>
| molecular_weight  = 635.70734 
| smiles            = CCOC1=C(C=C(C=C1)CC2=NCCC3=CC(=C(C=C32)OCC)OCC)OCC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O
| synonyms          = 
| density           = 
| melting_point     = 
| boiling_point     = 
| solubility        = 
| bioavailability   = 
| protein_bound     = 
| metabolism        =
| elimination_half-life = 
}}

==Description==


==Source==
N/A

==Function==
Unknown

==General Properties==
<b>*Molecular Weight</b>

635.70734 

<b>*Exact Mass</b>

635.295513

<b>*Molecular Formula</b>

C<sub>3</sub><sub>3</sub>H<sub>4</sub><sub>1</sub>N<sub>5</sub>O<sub>8</sub>

<b>*IUPAC NAME</b>

1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-3,4-dihydroisoquinoline;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid

<b>*Canonical Smiles</b>

CCOC1=C(C=C(C=C1)CC2=NCCC3=CC(=C(C=C32)OCC)OCC)OCC.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O

<b>*Isomeric Smiles</b>

N/A

<b>*XLogP</b>

N/A

<b>*Hydrogen bond donor</b>

1

<b>*Hydrogen bond acceptor</b>

10

<b>*Rotational Bond Count</b>

12

<b>*Topological Polar Surface Area</b>

145

==External Links==

*[http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=124905 Pubchem]

[http://crdd.osdd.net/raghava/biadb/detail.php?id=2056 Link to BIAdb Database]
[[Category:BIAdb]]