Source:http://biocyc.org/biopax/biopax-level3ChemicalStructure140490
| Predicate | Object |
|---|---|
| rdf:type | |
| biopax3:structureData |
<cml> <molecule id="DEOXYCYTIDINE" title="deoxycytidine" formalCharge="0" dictRef="dictDEOXYCYTIDINE"> <atomArray> <atom id="DEOXYCYTIDINE-atom1" elementType="N" x2="3383.0" y2="-5079.0"/> <atom id="DEOXYCYTIDINE-atom2" elementType="O" x2="1962.0" y2="-2612.0"/> <atom id="DEOXYCYTIDINE-atom3" elementType="O" x2="0.0" y2="-1157.0"/> <atom id="DEOXYCYTIDINE-atom4" elementType="O" x2="1156.0" y2="0.0"/> <atom id="DEOXYCYTIDINE-atom5" elementType="C" x2="4104.0" y2="-3848.0"/> <atom id="DEOXYCYTIDINE-atom6" elementType="C" x2="4104.0" y2="-3018.0"/> <atom id="DEOXYCYTIDINE-atom7" elementType="C" x2="612.0" y2="-1704.0"/> <atom id="DEOXYCYTIDINE-atom8" elementType="C" x2="2465.0" y2="-662.0"/> <atom id="DEOXYCYTIDINE-atom9" elementType="N" x2="2675.0" y2="-3848.0"/> <atom id="DEOXYCYTIDINE-atom10" elementType="O" x2="2050.0" y2="-1924.0"/> <atom id="DEOXYCYTIDINE-atom11" elementType="C" x2="3385.0" y2="-4258.0"/> <atom id="DEOXYCYTIDINE-atom12" elementType="C" x2="2675.0" y2="-3018.0"/> <atom id="DEOXYCYTIDINE-atom13" elementType="C" x2="1640.0" y2="-662.0"/> <atom id="DEOXYCYTIDINE-atom14" elementType="C" x2="1391.0" y2="-1447.0"/> <atom id="DEOXYCYTIDINE-atom15" elementType="C" x2="2718.0" y2="-1447.0"/> <atom id="DEOXYCYTIDINE-atom16" elementType="N" x2="3384.0" y2="-2597.0"/> </atomArray> <bondArray> <bond id="DEOXYCYTIDINE-bond1" atomRefs="DEOXYCYTIDINE-atom15 DEOXYCYTIDINE-atom16" order="1"/> <bond id="DEOXYCYTIDINE-bond2" atomRefs="DEOXYCYTIDINE-atom13 DEOXYCYTIDINE-atom14" order="1"/> <bond id="DEOXYCYTIDINE-bond3" atomRefs="DEOXYCYTIDINE-atom12 DEOXYCYTIDINE-atom16" order="1"/> <bond id="DEOXYCYTIDINE-bond4" atomRefs="DEOXYCYTIDINE-atom10 DEOXYCYTIDINE-atom15" order="1"/> <bond id="DEOXYCYTIDINE-bond5" atomRefs="DEOXYCYTIDINE-atom10 DEOXYCYTIDINE-atom14" order="1"/> <bond id="DEOXYCYTIDINE-bond6" atomRefs="DEOXYCYTIDINE-atom9 DEOXYCYTIDINE-atom12" order="1"/> <bond id="DEOXYCYTIDINE-bond7" atomRefs="DEOXYCYTIDINE-atom11 DEOXYCYTIDINE-atom9" order="2"/> <bond id="DEOXYCYTIDINE-bond8" atomRefs="DEOXYCYTIDINE-atom8 DEOXYCYTIDINE-atom15" order="1"/> <bond id="DEOXYCYTIDINE-bond9" atomRefs="DEOXYCYTIDINE-atom8 DEOXYCYTIDINE-atom13" order="1"/> <bond id="DEOXYCYTIDINE-bond10" atomRefs="DEOXYCYTIDINE-atom14 DEOXYCYTIDINE-atom7" order="1"/> <bond id="DEOXYCYTIDINE-bond11" atomRefs="DEOXYCYTIDINE-atom16 DEOXYCYTIDINE-atom6" order="1"/> <bond id="DEOXYCYTIDINE-bond12" atomRefs="DEOXYCYTIDINE-atom5 DEOXYCYTIDINE-atom11" order="1"/> <bond id="DEOXYCYTIDINE-bond13" atomRefs="DEOXYCYTIDINE-atom6 DEOXYCYTIDINE-atom5" order="2"/> <bond id="DEOXYCYTIDINE-bond14" atomRefs="DEOXYCYTIDINE-atom13 DEOXYCYTIDINE-atom4" order="1"/> <bond id="DEOXYCYTIDINE-bond15" atomRefs="DEOXYCYTIDINE-atom3 DEOXYCYTIDINE-atom7" order="1"/> <bond id="DEOXYCYTIDINE-bond16" atomRefs="DEOXYCYTIDINE-atom2 DEOXYCYTIDINE-atom12" order="2"/> <bond id="DEOXYCYTIDINE-bond17" atomRefs="DEOXYCYTIDINE-atom1 DEOXYCYTIDINE-atom11" order="1"/> </bondArray> <formula concise="H 13 C 9 O 4 N 3"/> <float title="molecularWeight" units="g/mol">227.219</float> <string title="smiles">C1(=CN(C(=O)N=C(N)1)C2(CC(O)C(CO)O2))</string> </molecule> </cml>
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| biopax3:structureFormat |
CML
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