Source:http://biocyc.org/biopax/biopax-level3ChemicalStructure171720
| Predicate | Object |
|---|---|
| rdf:type | |
| biopax3:structureData |
<cml> <molecule id="S-2-Hydroxyacids1" title="an (S)-2-hydroxyacid" formalCharge="0" dictRef="dictS-2-Hydroxyacids1"> <atomArray> <atom id="S-2-Hydroxyacids1-atom1" elementType="H" x2="9772.0" y2="-34186.0"/> <atom id="S-2-Hydroxyacids1-atom2" elementType="O" x2="26667.0" y2="-627.0"/> <atom id="S-2-Hydroxyacids1-atom3" elementType="O" x2="7099.0" y2="0.0"/> <atom id="S-2-Hydroxyacids1-atom4" elementType="O" x2="29388.0" y2="-20854.0"/> <atom id="S-2-Hydroxyacids1-atom5" elementType="R1" x2="0.0" y2="-13007.0"/> <atom id="S-2-Hydroxyacids1-atom6" elementType="C" x2="15815.0" y2="-6382.0"/> <atom id="S-2-Hydroxyacids1-atom7" elementType="C" x2="15732.0" y2="-21859.0"/> </atomArray> <bondArray> <bond id="S-2-Hydroxyacids1-bond1" atomRefs="S-2-Hydroxyacids1-atom7 S-2-Hydroxyacids1-atom6" order="1"/> <bond id="S-2-Hydroxyacids1-bond2" atomRefs="S-2-Hydroxyacids1-atom5 S-2-Hydroxyacids1-atom7" order="1"/> <bond id="S-2-Hydroxyacids1-bond3" atomRefs="S-2-Hydroxyacids1-atom4 S-2-Hydroxyacids1-atom7" order="1"/> <bond id="S-2-Hydroxyacids1-bond4" atomRefs="S-2-Hydroxyacids1-atom3 S-2-Hydroxyacids1-atom6" order="1"/> <bond id="S-2-Hydroxyacids1-bond5" atomRefs="S-2-Hydroxyacids1-atom2 S-2-Hydroxyacids1-atom6" order="2"/> <bond id="S-2-Hydroxyacids1-bond6" atomRefs="S-2-Hydroxyacids1-atom1 S-2-Hydroxyacids1-atom7" order="1"/> </bondArray> <formula concise=""/> <string title="smiles">C(=O)(O)[CH](O)[R1]</string> </molecule> </cml>
|
| biopax3:structureFormat |
CML
|