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CHEBI:67790 - Blumeaene E1

ChEBI IDCHEBI:67790
ChEBI NameBlumeaene E1
Stars
DefinitionA natural product found in Blumea balsamifera.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H30O6
Net Charge0
Average Mass366.454
Monoisotopic Mass366.20424
SMILESCC1=C2C(=O)[C@H](C(C)C)C[C@H](OC(=O)[C@@]3(C)O[C@H]3C)[C@@](C)(O)[C@]2(O)CC1
InChIInChI=1S/C20H30O6/c1-10(2)13-9-14(25-17(22)18(5)12(4)26-18)19(6,23)20(24)8-7-11(3)15(20)16(13)21/h10,12-14,23-24H,7-9H2,1-6H3/t12-,13-,14-,18-,19+,20-/m0/s1
InChIKeyIKMKRVIHSCZYGK-SOPFVOOMSA-N
Species of MetaboliteComponentSourceComments
Blumea balsamifera (ncbitaxon:313920) leaf (BTO:0000713) PubMed (21319848) Methanolic extract of air-dried, powdered leaves
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)
Blumeaene E1 (CHEBI:67790) has role metabolite (CHEBI:25212)
Blumeaene E1 (CHEBI:67790) is a sesquiterpenoid (CHEBI:26658)
Citations