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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_70523
http://purl.obolibrary.org/obo/CHEBI_70523
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_70523
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Preferred name
Meliasenin O
Synonyms
(24R)-hydroperoxyeupha-7,25-dien-3-oxo-16beta,21beta-olide
Raw data
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#2_STAR
obo_purl:smiles
[H][C@]12C[C@]3(C)C4=CC[C@@]5([H])C(C)(C)C(=O)CC[C@]5(C)[C@@]4([H])CC[C@@]3(C)[C@]1([H])[C@@]([H])(CC[C@@H](OO)C(C)=C)C(=O)O2
obo_purl:charge
0
obo_purl:inchikey
HASDXLPYERWHOW-STBDDEOLSA-N
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_25212
oboinowl_gen:hasDbXref
PMID:20961091
skos:notation
CHEBI:70523
obo_purl:mass
484.66740
obo_purl:inchi
InChI=1S/C30H44O5/c1-17(2)21(35-33)10-8-18-25-22(34-26(18)32)16-30(7)20-9-11-23-27(3,4)24(31)13-14-28(23,5)19(20)12-15-29(25,30)6/h9,18-19,21-23,25,33H,1,8,10-16H2,2-7H3/t18-,19+,21-,22+,23+,25-,28-,29+,30-/m1/s1
obo_purl:formula
C30H44O5
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
(24R)-hydroperoxyeupha-7,25-dien-3-oxo-16beta,21beta-olide
oboinowl_gen:id
CHEBI:70523
rdfs:label
Meliasenin O
obo_purl:monoisotopicmass
484.31887
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_36615
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