EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70528 - kulinone

Default Structure
ChEBI IDCHEBI:70528
ChEBI Namekulinone
Stars
DefinitionA natural product found in Melia toosendan.
Last Modified22 September 2014
DownloadsMolfile
FormulaC30H48O2
Net Charge0
Average Mass440.712
Monoisotopic Mass440.36543
SMILES[H][C@@]1([C@H](C)CCC=C(C)C)[C@@H](O)C[C@]2(C)C3=CC[C@@]4([H])C(C)(C)C(=O)CC[C@]4(C)[C@@]3([H])CC[C@@]12C
InChIInChI=1S/C30H48O2/c1-19(2)10-9-11-20(3)26-23(31)18-30(8)22-12-13-24-27(4,5)25(32)15-16-28(24,6)21(22)14-17-29(26,30)7/h10,12,20-21,23-24,26,31H,9,11,13-18H2,1-8H3/t20-,21+,23+,24+,26-,28-,29+,30-/m1/s1
InChIKeyYORJEFOAAXJWIS-QOXWJFHWSA-N
Species of MetaboliteComponentSourceComments
Melia toosendan (ncbitaxon:71608) fruit (BTO:0000486) PubMed (20961091) 95% ethanolic extract of dried fruits
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
kulinone (CHEBI:70528) has role metabolite (CHEBI:25212)
kulinone (CHEBI:70528) is a triterpenoid (CHEBI:36615)
Synonym  Source
Lanosta-7,24-dien-3-one,16-hydroxy-,(13alpha,14beta,16beta,17alpha)-ChEBI
Registry NumbersSources
CAS:21688-61-9ChemIDplus
Citations