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CHEBI:67792 - Blumeaene K, (rel)-

ChEBI IDCHEBI:67792
ChEBI NameBlumeaene K, (rel)-
Stars
DefinitionA natural product found in Blumea balsamifera.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H32O7
Net Charge0
Average Mass384.469
Monoisotopic Mass384.21480
SMILESCC1=C2C(=O)[C@H](C(C)C)C[C@H](OC(=O)C(C)(O)C(C)O)[C@@](C)(O)[C@]2(O)CC1
InChIInChI=1S/C20H32O7/c1-10(2)13-9-14(27-17(23)18(5,24)12(4)21)19(6,25)20(26)8-7-11(3)15(20)16(13)22/h10,12-14,21,24-26H,7-9H2,1-6H3/t12?,13-,14-,18?,19+,20-/m0/s1
InChIKeyDOZVKVJPJOEXOY-QSUDUBMPSA-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 K, (rel)- (CHEBI:67792) has role metabolite (CHEBI:25212)
Blumeaene K, (rel)- (CHEBI:67792) is a sesquiterpenoid (CHEBI:26658)
Citations