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<table align='right' border=1><tr><td><jmol><jmolApplet><size>200</size><script>spin on;color atoms amino;</script><uploadedFileContents>5281386.SDF</uploadedFileContents><color>black</color></jmolApplet></jmol></td></tr></table>
[http://crdd.osdd.net/raghava/biadb/str.php?id=5281386&show=SHOW-3D Show 3-D Structure]

[http://crdd.osdd.net/raghava/biadb/str.php?id=5281386&show=SHOW-2D Show 2-D Structure]

{{Drugbox
| IUPAC_name        =N/A
| PubChem           = 5281386
| DrugBank          =
| ChemSpiderID      =
| chemical_formula  =C<sub>4</sub><sub>0</sub>H<sub>4</sub><sub>4</sub>N<sub>4</sub>O+<sub>2</sub>
| molecular_weight  = 596.80356 
| smiles            = CC=C1C[N+]2(CCC34C2CC1C5=CN6C7=CC=CC=C7C89C61C(=CN(C53O1)C1=CC=CC=C41)C1CC8[N+](CC9)(CC1=CC)C)C
| synonyms          = 
| density           = 
| melting_point     = 
| boiling_point     = 
| solubility        = 
| bioavailability   = 
| protein_bound     = 
| metabolism        =
| elimination_half-life = 
}}

==Description==


==Source==
Strychnos usambarensis

==Function==
Toxic

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

596.80356 

<b>*Exact Mass</b>

596.351512

<b>*Molecular Formula</b>

C<sub>4</sub><sub>0</sub>H<sub>4</sub><sub>4</sub>N<sub>4</sub>O+<sub>2</sub>

<b>*IUPAC NAME</b>

N/A

<b>*Canonical Smiles</b>

CC=C1C[N+]2(CCC34C2CC1C5=CN6C7=CC=CC=C7C89C61C(=CN(C53O1)C1=CC=CC=C41)C1CC8[N+](CC9)(CC1=CC)C)C

<b>*Isomeric Smiles</b>

C/C=C/1[C@H]2C3=CN4[C@@]56O[C@]37N(C8=CC=CC=C8[C@]79[C@H](C2)[N@+](C1)(CC9)C)C=C5[C@@H]1/C(=CC)/C[N@+]2([C@H]([C@]6(C3=CC=CC=C43)CC2)C1)C

<b>*XLogP</b>

3.7

<b>*Hydrogen bond donor</b>

0

<b>*Hydrogen bond acceptor</b>

3

<b>*Rotational Bond Count</b>

0

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

15.7

==External Links==

*[http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=5281386 Pubchem]

*[http://www.genome.jp/dbget-bin/www_bget?cpd:C09144 KEGG]

[http://crdd.osdd.net/raghava/biadb/detail.php?id=1695 Link to BIAdb Database]
[[Category:BIAdb]]