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CHEBI:70296 - Yungensin C

ChEBI IDCHEBI:70296
ChEBI NameYungensin C
Stars
DefinitionA natural product found in Elaphoglossum yungense.
Last Modified22 September 2014
DownloadsMolfile
FormulaC40H52O8
Net Charge0
Average Mass660.848
Monoisotopic Mass660.36622
SMILESCCCC(=O)c1c(O)c(CC2=C(O)C(C)(C/C=C(\C)CCC=C(C)C)C(O)=C(C(C)=O)C2=O)c(O)c2c1OC(C)(CCC=C(C)C)C=C2
InChIInChI=1S/C40H52O8/c1-10-13-30(42)32-34(44)28(33(43)27-18-20-39(8,48-36(27)32)19-12-15-24(4)5)22-29-35(45)31(26(7)41)38(47)40(9,37(29)46)21-17-25(6)16-11-14-23(2)3/h14-15,17-18,20,43-44,46-47H,10-13,16,19,21-22H2,1-9H3/b25-17+
InChIKeyUKQRDKMWMFEWPI-KOEQRZSOSA-N
Species of MetaboliteComponentSourceComments
Elaphoglossum yungense (ncbitaxon:551654)
root (BTO:0001188) PubMed (21043474) Et2O extract of air-dried and ground scaly rhizomes and roots
rhizome (BTO:0001181) PubMed (21043474) Et2O extract of air-dried and ground scaly rhizomes and roots
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)
Yungensin C (CHEBI:70296) has role metabolite (CHEBI:25212)
Yungensin C (CHEBI:70296) is a butanone (CHEBI:22951)
Synonym  Source
2-{[5,7-dihydroxy-2-methyl-2-(4-methyl-3-pentenyl)-8-butanoyl-6-chromenyl]methyl}-3,5-dihydroxy-4-methyl-4-(3,7-dimethyl-2,6-octadienyl)-6-acetyl-2,5-cyclohexadien-1-oneChEBI
Citations