Source:http://biocyc.org/biopax/biopax-level3ChemicalStructure160000
| Predicate | Object |
|---|---|
| rdf:type | |
| biopax3:structureData |
<cml> <molecule id="Glycogens" title="a glycogen" formalCharge="0" dictRef="dictGlycogens"> <atomArray> <atom id="Glycogens-atom1" elementType="C" x2="-66900.0" y2="-198990.0"/> <atom id="Glycogens-atom2" elementType="C" x2="-37120.0" y2="-117410.0"/> <atom id="Glycogens-atom3" elementType="O" x2="-142880.0" y2="-236980.0"/> <atom id="Glycogens-atom4" elementType="C" x2="-12090.0" y2="-258560.0"/> <atom id="Glycogens-atom5" elementType="O" x2="46190.0" y2="-104030.0"/> <atom id="Glycogens-atom6" elementType="C" x2="-91080.0" y2="-53960.0"/> <atom id="Glycogens-atom7" elementType="C" x2="-220570.0" y2="-210650.0"/> <atom id="Glycogens-atom8" elementType="C" x2="66480.0" y2="-244750.0"/> <atom id="Glycogens-atom9" elementType="O" x2="-37990.0" y2="-337120.0"/> <atom id="Glycogens-atom10" elementType="C" x2="96690.0" y2="-170070.0"/> <atom id="Glycogens-atom11" elementType="O" x2="-50070.0" y2="16840.0"/> <atom id="Glycogens-atom12" elementType="O" x2="-250790.0" y2="-134250.0"/> <atom id="Glycogens-atom13" elementType="C" x2="-273240.0" y2="-276690.0"/> <atom id="Glycogens-atom14" elementType="O" x2="118270.0" y2="-308630.0"/> <atom id="Glycogens-atom15" elementType="O" x2="180430.0" y2="-180860.0"/> <atom id="Glycogens-atom16" elementType="C" x2="-103600.0" y2="79420.0"/> <atom id="Glycogens-atom17" elementType="C" x2="-333670.0" y2="-123890.0"/> <atom id="Glycogens-atom18" elementType="C" x2="-353100.0" y2="-265900.0"/> <atom id="Glycogens-atom19" elementType="O" x2="-242590.0" y2="-353530.0"/> <atom id="Glycogens-atom20" elementType="C" x2="244750.0" y2="-129930.0"/> <atom id="Glycogens-atom21" elementType="O" x2="-75970.0" y2="156690.0"/> <atom id="Glycogens-atom22" elementType="C" x2="-184320.0" y2="64320.0"/> <atom id="Glycogens-atom23" elementType="C" x2="-384600.0" y2="-190360.0"/> <atom id="Glycogens-atom24" elementType="C" x2="-369930.0" y2="-48780.0"/> <atom id="Glycogens-atom25" elementType="O" x2="-403600.0" y2="-331510.0"/> <atom id="Glycogens-atom26" elementType="C" x2="249070.0" y2="-47480.0"/> <atom id="Glycogens-atom27" elementType="C" x2="315540.0" y2="-172660.0"/> <atom id="Glycogens-atom28" elementType="C" x2="-129500.0" y2="219280.0"/> <atom id="Glycogens-atom29" elementType="C" x2="-237840.0" y2="126480.0"/> <atom id="Glycogens-atom30" elementType="O" x2="-210650.0" y2="-14240.0"/> <atom id="Glycogens-atom31" elementType="O" x2="-466190.0" y2="-181300.0"/> <atom id="Glycogens-atom32" elementType="O" x2="-314680.0" y2="9930.0"/> <atom id="Glycogens-atom33" elementType="O" x2="322880.0" y2="-9070.0"/> <atom id="Glycogens-atom34" elementType="C" x2="182590.0" y2="-860.0"/> <atom id="Glycogens-atom35" elementType="C" x2="386330.0" y2="-135970.0"/> <atom id="Glycogens-atom36" elementType="O" x2="312520.0" y2="-255540.0"/> <atom id="Glycogens-atom37" elementType="C" x2="-210650.0" y2="204170.0"/> <atom id="Glycogens-atom38" elementType="C" x2="-95400.0" y2="298270.0"/> <atom id="Glycogens-atom39" elementType="O" x2="-318560.0" y2="109640.0"/> <atom id="Glycogens-atom40" elementType="C" x2="391510.0" y2="-53530.0"/> <atom id="Glycogens-atom41" elementType="O" x2="208060.0" y2="78130.0"/> <atom id="Glycogens-atom42" elementType="O" x2="454530.0" y2="-181300.0"/> <atom id="Glycogens-atom43" elementType="O" x2="-266770.0" y2="266770.0"/> <atom id="Glycogens-atom44" elementType="O" x2="-153670.0" y2="355250.0"/> <atom id="Glycogens-atom45" elementType="O" x2="465760.0" y2="-16400.0"/> </atomArray> <bondArray> <bond id="Glycogens-bond1" atomRefs="Glycogens-atom40 Glycogens-atom35" order="1"/> <bond id="Glycogens-bond2" atomRefs="Glycogens-atom37 Glycogens-atom29" order="1"/> <bond id="Glycogens-bond3" atomRefs="Glycogens-atom18 Glycogens-atom23" order="1"/> <bond id="Glycogens-bond4" atomRefs="Glycogens-atom10 Glycogens-atom8" order="1"/> <bond id="Glycogens-bond5" atomRefs="Glycogens-atom40 Glycogens-atom45" order="1"/> <bond id="Glycogens-bond6" atomRefs="Glycogens-atom38 Glycogens-atom44" order="1"/> <bond id="Glycogens-bond7" atomRefs="Glycogens-atom37 Glycogens-atom43" order="1"/> <bond id="Glycogens-bond8" atomRefs="Glycogens-atom35 Glycogens-atom42" order="1"/> <bond id="Glycogens-bond9" atomRefs="Glycogens-atom34 Glycogens-atom41" order="1"/> <bond id="Glycogens-bond10" atomRefs="Glycogens-atom33 Glycogens-atom40" order="1"/> <bond id="Glycogens-bond11" atomRefs="Glycogens-atom29 Glycogens-atom39" order="1"/> <bond id="Glycogens-bond12" atomRefs="Glycogens-atom28 Glycogens-atom38" order="1"/> <bond id="Glycogens-bond13" atomRefs="Glycogens-atom28 Glycogens-atom37" order="1"/> <bond id="Glycogens-bond14" atomRefs="Glycogens-atom27 Glycogens-atom36" order="1"/> <bond id="Glycogens-bond15" atomRefs="Glycogens-atom35 Glycogens-atom27" order="1"/> <bond id="Glycogens-bond16" atomRefs="Glycogens-atom26 Glycogens-atom34" order="1"/> <bond id="Glycogens-bond17" atomRefs="Glycogens-atom26 Glycogens-atom33" order="1"/> <bond id="Glycogens-bond18" atomRefs="Glycogens-atom24 Glycogens-atom32" order="1"/> <bond id="Glycogens-bond19" atomRefs="Glycogens-atom23 Glycogens-atom31" order="1"/> <bond id="Glycogens-bond20" atomRefs="Glycogens-atom22 Glycogens-atom30" order="1"/> <bond id="Glycogens-bond21" atomRefs="Glycogens-atom29 Glycogens-atom22" order="1"/> <bond id="Glycogens-bond22" atomRefs="Glycogens-atom21 Glycogens-atom28" order="1"/> <bond id="Glycogens-bond23" atomRefs="Glycogens-atom27 Glycogens-atom20" order="1"/> <bond id="Glycogens-bond24" atomRefs="Glycogens-atom20 Glycogens-atom26" order="1"/> <bond id="Glycogens-bond25" atomRefs="Glycogens-atom18 Glycogens-atom25" order="1"/> <bond id="Glycogens-bond26" atomRefs="Glycogens-atom17 Glycogens-atom24" order="1"/> <bond id="Glycogens-bond27" atomRefs="Glycogens-atom23 Glycogens-atom17" order="1"/> <bond id="Glycogens-bond28" atomRefs="Glycogens-atom22 Glycogens-atom16" order="1"/> <bond id="Glycogens-bond29" atomRefs="Glycogens-atom16 Glycogens-atom21" order="1"/> <bond id="Glycogens-bond30" atomRefs="Glycogens-atom20 Glycogens-atom15" order="1"/> <bond id="Glycogens-bond31" atomRefs="Glycogens-atom13 Glycogens-atom19" order="1"/> <bond id="Glycogens-bond32" atomRefs="Glycogens-atom13 Glycogens-atom18" order="1"/> <bond id="Glycogens-bond33" atomRefs="Glycogens-atom17 Glycogens-atom12" order="1"/> <bond id="Glycogens-bond34" atomRefs="Glycogens-atom16 Glycogens-atom11" order="1"/> <bond id="Glycogens-bond35" atomRefs="Glycogens-atom10 Glycogens-atom15" order="1"/> <bond id="Glycogens-bond36" atomRefs="Glycogens-atom8 Glycogens-atom14" order="1"/> <bond id="Glycogens-bond37" atomRefs="Glycogens-atom7 Glycogens-atom13" order="1"/> <bond id="Glycogens-bond38" atomRefs="Glycogens-atom12 Glycogens-atom7" order="1"/> <bond id="Glycogens-bond39" atomRefs="Glycogens-atom6 Glycogens-atom11" order="1"/> <bond id="Glycogens-bond40" atomRefs="Glycogens-atom5 Glycogens-atom10" order="1"/> <bond id="Glycogens-bond41" atomRefs="Glycogens-atom4 Glycogens-atom9" order="1"/> <bond id="Glycogens-bond42" atomRefs="Glycogens-atom8 Glycogens-atom4" order="1"/> <bond id="Glycogens-bond43" atomRefs="Glycogens-atom7 Glycogens-atom3" order="1"/> <bond id="Glycogens-bond44" atomRefs="Glycogens-atom2 Glycogens-atom6" order="1"/> <bond id="Glycogens-bond45" atomRefs="Glycogens-atom2 Glycogens-atom5" order="1"/> <bond id="Glycogens-bond46" atomRefs="Glycogens-atom4 Glycogens-atom1" order="1"/> <bond id="Glycogens-bond47" atomRefs="Glycogens-atom1 Glycogens-atom3" order="1"/> <bond id="Glycogens-bond48" atomRefs="Glycogens-atom1 Glycogens-atom2" order="1"/> </bondArray> <formula concise="H 42 O 21 C 24"/> <float title="molecularWeight" units="g/mol">666.583</float> <string title="smiles">C(C2(C(OC1(OC(C(O)C(C1O)O)CO))C(C(O)C(O2)OC3(C(OC(O)C(C3O)O)CO))O))OC4(OC(C(O)C(C4O)O)CO)</string> </molecule> </cml>
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| biopax3:structureFormat |
CML
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