Source:http://biocyc.org/biopax/biopax-level3ChemicalStructure140450
Predicate | Object |
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rdf:type | |
biopax3:structureData |
<cml> <molecule id="URIDINE" title="uridine" formalCharge="0" dictRef="dictURIDINE"> <atomArray> <atom id="URIDINE-atom1" elementType="C" x2="0.0" y2="825.0"/> <atom id="URIDINE-atom2" elementType="N" x2="0.0" y2="0.0"/> <atom id="URIDINE-atom3" elementType="O" x2="-667.0" y2="1310.0"/> <atom id="URIDINE-atom4" elementType="C" x2="668.0" y2="1310.0"/> <atom id="URIDINE-atom5" elementType="C" x2="714.0" y2="-412.0"/> <atom id="URIDINE-atom6" elementType="C" x2="-714.0" y2="-412.0"/> <atom id="URIDINE-atom7" elementType="C" x2="-412.0" y2="2095.0"/> <atom id="URIDINE-atom8" elementType="C" x2="412.0" y2="2095.0"/> <atom id="URIDINE-atom9" elementType="O" x2="1452.0" y2="1055.0"/> <atom id="URIDINE-atom10" elementType="N" x2="714.0" y2="-1238.0"/> <atom id="URIDINE-atom11" elementType="O" x2="1429.0" y2="0.0"/> <atom id="URIDINE-atom12" elementType="C" x2="-714.0" y2="-1238.0"/> <atom id="URIDINE-atom13" elementType="O" x2="898.0" y2="2762.0"/> <atom id="URIDINE-atom14" elementType="C" x2="0.0" y2="-1650.0"/> <atom id="URIDINE-atom15" elementType="C" x2="-897.0" y2="2762.0"/> <atom id="URIDINE-atom16" elementType="O" x2="-562.0" y2="3516.0"/> <atom id="URIDINE-atom17" elementType="O" x2="0.0" y2="-2475.0"/> </atomArray> <bondArray> <bond id="URIDINE-bond1" atomRefs="URIDINE-atom1 URIDINE-atom2" order="1"/> <bond id="URIDINE-bond2" atomRefs="URIDINE-atom1 URIDINE-atom3" order="1"/> <bond id="URIDINE-bond3" atomRefs="URIDINE-atom1 URIDINE-atom4" order="1"/> <bond id="URIDINE-bond4" atomRefs="URIDINE-atom2 URIDINE-atom5" order="1"/> <bond id="URIDINE-bond5" atomRefs="URIDINE-atom2 URIDINE-atom6" order="1"/> <bond id="URIDINE-bond6" atomRefs="URIDINE-atom3 URIDINE-atom7" order="1"/> <bond id="URIDINE-bond7" atomRefs="URIDINE-atom4 URIDINE-atom8" order="1"/> <bond id="URIDINE-bond8" atomRefs="URIDINE-atom4 URIDINE-atom9" order="1"/> <bond id="URIDINE-bond9" atomRefs="URIDINE-atom5 URIDINE-atom10" order="1"/> <bond id="URIDINE-bond10" atomRefs="URIDINE-atom5 URIDINE-atom11" order="2"/> <bond id="URIDINE-bond11" atomRefs="URIDINE-atom6 URIDINE-atom12" order="2"/> <bond id="URIDINE-bond12" atomRefs="URIDINE-atom7 URIDINE-atom15" order="1"/> <bond id="URIDINE-bond13" atomRefs="URIDINE-atom8 URIDINE-atom13" order="1"/> <bond id="URIDINE-bond14" atomRefs="URIDINE-atom10 URIDINE-atom14" order="1"/> <bond id="URIDINE-bond15" atomRefs="URIDINE-atom14 URIDINE-atom17" order="2"/> <bond id="URIDINE-bond16" atomRefs="URIDINE-atom7 URIDINE-atom8" order="1"/> <bond id="URIDINE-bond17" atomRefs="URIDINE-atom12 URIDINE-atom14" order="1"/> <bond id="URIDINE-bond18" atomRefs="URIDINE-atom15 URIDINE-atom16" order="1"/> </bondArray> <formula concise="H 12 O 6 N 2 C 9"/> <float title="molecularWeight" units="g/mol">244.204</float> <string title="smiles">C1(C(O)C(C(CO)O1)O)N2(C=CC(=O)NC(=O)2)</string> </molecule> </cml>
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biopax3:structureFormat |
CML
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