{"@context":{"obo_purl":"http://purl.obolibrary.org/obo/","rdf":"http://www.w3.org/1999/02/22-rdf-syntax-ns#","owl":"http://www.w3.org/2002/07/owl#","rdfs":"http://www.w3.org/2000/01/rdf-schema#","skos":"http://www.w3.org/2004/02/skos/core#","oboinowl_gen":"http://www.geneontology.org/formats/oboInOwl#","ns0":"http://purl.obolibrary.org/obo/chebi#","metadata_def":"http://data.bioontology.org/metadata/def/","ns1":"http://purl.obolibrary.org/obo/chebi/"},"@id":"obo_purl:CHEBI_169570","@type":"owl:Class","rdfs:subClassOf":[{"@id":"obo_purl:CHEBI_18059"},{"@id":"obo_purl:CHEBI_37622"}],"rdfs:label":"N-(3E-hexadecenoyl)-deoxysphing-4-enine-1-sulfonate","skos:notation":"CHEBI:169570","oboinowl_gen:hasExactSynonym":"(E,2R,3R)-2-[[(E)-hexadec-3-enoyl]amino]-3-hydroxyoctadec-4-ene-1-sulonic acid","oboinowl_gen:hasDbXref":["Chemspider:24823203","LIPID_MAPS_instance:LMSP00000003"],"oboinowl_gen:hasOBONamespace":"chebi_ontology","oboinowl_gen:id":"CHEBI:169570","oboinowl_gen:inSubset":{"@id":"ns0:2_STAR"},"metadata_def:prefLabel":"N-(3E-hexadecenoyl)-deoxysphing-4-enine-1-sulfonate","metadata_def:mappingLoom":"n3ehexadecenoyldeoxysphing4enine1sulfonate","metadata_def:mappingSameURI":{"@id":"obo_purl:CHEBI_169570"},"ns1:charge":"0","ns1:formula":"C34H65NO5S","ns1:inchi":"InChI=1S/C34H65NO5S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(36)32(31-41(38,39)40)35-34(37)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h26-29,32-33,36H,3-25,30-31H2,1-2H3,(H,35,37)(H,38,39,40)/b28-26+,29-27+/t32-,33+/m0/s1","ns1:inchikey":"FPTGOQRFJXQGQS-SAWZVONUSA-N","ns1:mass":"599.960","ns1:monoisotopicmass":"599.45835","ns1:smiles":"S(O)(=O)(=O)C[C@H](NC(=O)C\\C=C\\CCCCCCCCCCCC)[C@H](O)\\C=C\\CCCCCCCCCCCCC"}