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Ontologies
CHEBI
Chemical Entities of Biological Interest Ontology
(CHEBI)
OBO
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Last submission date May 11, 2023
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<div><div class='d-flex align-items-center'> <span class="flag-icon flag-icon-gb"></span> <div class='ml-1'> English </div> </div> </div>
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ID
http://purl.obolibrary.org/obo/CHEBI_82114
http://purl.obolibrary.org/obo/CHEBI_82114
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_82114
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Preferred name
Demephion-O
Raw data
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#2_STAR
obo_purl:smiles
COP(=S)(OC)OCCSC
obo_purl:charge
0
obo_purl:inchikey
IATBEFPCSHFQJS-UHFFFAOYSA-N
oboinowl_gen:hasDbXref
KEGG:C18975
CAS:682-80-4
PPDB:2756
skos:notation
CHEBI:82114
obo_purl:mass
216.25900
obo_purl:inchi
InChI=1S/C5H13O3PS2/c1-6-9(10,7-2)8-4-5-11-3/h4-5H2,1-3H3
obo_purl:formula
C5H13O3PS2
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:id
CHEBI:82114
rdfs:label
Demephion-O
obo_purl:monoisotopicmass
216.00437
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_37512
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