biopax-level3ChemicalStructure160132

Source:http://biocyc.org/biopax/biopax-level3ChemicalStructure160132

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	biopax3:ChemicalStructure
biopax3:structureData	<cml> <molecule id="CPD-5167" title="a (mannosyl)8-(N-acetylglucosaminyl)2-diphosphodolichol" formalCharge="-2" dictRef="dictCPD-5167"> <atomArray> <atom id="CPD-5167-atom1" elementType="C" x2="287070.0" y2="90000.0"/> <atom id="CPD-5167-atom2" elementType="C" x2="215630.0" y2="131250.0"/> <atom id="CPD-5167-atom3" elementType="C" x2="144180.0" y2="90000.0"/> <atom id="CPD-5167-atom4" elementType="C" x2="215630.0" y2="213750.0"/> <atom id="CPD-5167-atom5" elementType="C" x2="144180.0" y2="7500.0"/> <atom id="CPD-5167-atom6" elementType="C" x2="72730.0" y2="-33750.0"/> <atom id="CPD-5167-atom7" elementType="C" x2="72730.0" y2="-116250.0"/> <atom id="CPD-5167-atom8" elementType="C" x2="144180.0" y2="-157500.0"/> <atom id="CPD-5167-atom9" elementType="C" x2="1280.0" y2="-157500.0"/> <atom id="CPD-5167-atom10" elementType="C" x2="1280.0" y2="-240000.0"/> <atom id="CPD-5167-atom11" elementType="C" x2="-70160.0" y2="-363750.0"/> <atom id="CPD-5167-atom12" 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CPD-5167-atom39" order="2"/> <bond id="CPD-5167-bond178" atomRefs="CPD-5167-atom37 CPD-5167-atom38" order="1"/> <bond id="CPD-5167-bond179" atomRefs="CPD-5167-atom35 CPD-5167-atom36" order="1"/> <bond id="CPD-5167-bond180" atomRefs="CPD-5167-atom35 CPD-5167-atom37" order="1"/> <bond id="CPD-5167-bond181" atomRefs="CPD-5167-atom34 CPD-5167-atom36" order="1"/> <bond id="CPD-5167-bond182" atomRefs="CPD-5167-atom32 CPD-5167-atom34" order="2"/> <bond id="CPD-5167-bond183" atomRefs="CPD-5167-atom32 CPD-5167-atom33" order="1"/> <bond id="CPD-5167-bond184" atomRefs="CPD-5167-atom31 CPD-5167-atom32" order="1"/> <bond id="CPD-5167-bond185" atomRefs="CPD-5167-atom31 CPD-5167-atom30" order="1"/> <bond id="CPD-5167-bond186" atomRefs="CPD-5167-atom29 CPD-5167-atom30" order="1"/> <bond id="CPD-5167-bond187" atomRefs="CPD-5167-atom27 CPD-5167-atom29" order="2"/> <bond id="CPD-5167-bond188" atomRefs="CPD-5167-atom27 CPD-5167-atom28" order="1"/> <bond id="CPD-5167-bond189" atomRefs="CPD-5167-atom25 CPD-5167-atom26" order="1"/> <bond id="CPD-5167-bond190" atomRefs="CPD-5167-atom25 CPD-5167-atom27" order="1"/> <bond id="CPD-5167-bond191" atomRefs="CPD-5167-atom18 CPD-5167-atom24" order="1"/> <bond id="CPD-5167-bond192" atomRefs="CPD-5167-atom23 CPD-5167-atom24" order="1"/> <bond id="CPD-5167-bond193" atomRefs="CPD-5167-atom21 CPD-5167-atom23" order="2"/> <bond id="CPD-5167-bond194" atomRefs="CPD-5167-atom21 CPD-5167-atom22" order="1"/> <bond id="CPD-5167-bond195" atomRefs="CPD-5167-atom19 CPD-5167-atom21" order="1"/> <bond id="CPD-5167-bond196" atomRefs="CPD-5167-atom19 CPD-5167-atom20" order="1"/> <bond id="CPD-5167-bond197" atomRefs="CPD-5167-atom17 CPD-5167-atom26" order="1"/> <bond id="CPD-5167-bond198" atomRefs="CPD-5167-atom15 CPD-5167-atom17" order="2"/> <bond id="CPD-5167-bond199" atomRefs="CPD-5167-atom15 CPD-5167-atom16" order="1"/> <bond id="CPD-5167-bond200" atomRefs="CPD-5167-atom18 CPD-5167-atom15" order="1"/> <bond id="CPD-5167-bond201" atomRefs="CPD-5167-atom14 CPD-5167-atom20" order="1"/> <bond id="CPD-5167-bond202" atomRefs="CPD-5167-atom11 CPD-5167-atom12" order="1"/> <bond id="CPD-5167-bond203" atomRefs="CPD-5167-atom11 CPD-5167-atom14" order="2"/> <bond id="CPD-5167-bond204" atomRefs="CPD-5167-atom11 CPD-5167-atom13" order="1"/> <bond id="CPD-5167-bond205" atomRefs="CPD-5167-atom10 CPD-5167-atom12" order="1"/> <bond id="CPD-5167-bond206" atomRefs="CPD-5167-atom9 CPD-5167-atom10" order="1"/> <bond id="CPD-5167-bond207" atomRefs="CPD-5167-atom7 CPD-5167-atom9" order="2"/> <bond id="CPD-5167-bond208" atomRefs="CPD-5167-atom7 CPD-5167-atom8" order="1"/> <bond id="CPD-5167-bond209" atomRefs="CPD-5167-atom7 CPD-5167-atom6" order="1"/> <bond id="CPD-5167-bond210" atomRefs="CPD-5167-atom5 CPD-5167-atom6" order="1"/> <bond id="CPD-5167-bond211" atomRefs="CPD-5167-atom3 CPD-5167-atom5" order="1"/> <bond id="CPD-5167-bond212" atomRefs="CPD-5167-atom2 CPD-5167-atom4" order="1"/> <bond id="CPD-5167-bond213" atomRefs="CPD-5167-atom2 CPD-5167-atom3" order="2"/> <bond id="CPD-5167-bond214" atomRefs="CPD-5167-atom2 CPD-5167-atom1" order="1"/> </bondArray> <formula concise="H 238 P 2 N 2 O 57 C 144"/> <float title="molecularWeight" units="g/mol">2971.391</float> <string title="smiles">CC(=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(CCOP(OP(OC1(OC(CO)C(C(O)C(NC(C)=O)1)OC2(C(C(C(C(O2)CO)OC3(C(C(C(C(O3)COC4(C(C(C(C(O4)COC5(C(C(C(C(O5)CO)O)O)O))O)OC6(C(C(C(C(O6)CO)O)O)OC7(C(C(C(C(O7)CO)O)O)O)))O))O)OC8(C(C(C(C(O8)CO)O)O)OC9(C(C(C(C(O9)CO)O)O)OC%10(C(C(C(C(O%10)CO)O)O)O))))O))O)NC(=O)C)))(=O)[O-])(=O)[O-])C)C</string> </molecule> </cml>
biopax3:structureFormat	CML