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CHEBI:133830 - tensyuic acid D

ChEBI IDCHEBI:133830
ChEBI Nametensyuic acid D
Stars
DefinitionA tensyuic acid that is tensyuic acid B in which the non-conjugated carboxy group has been converted to the corresponding methyl ester. The (+)-isomer, isolated from Aspergillus niger FKI-2342.
Last Modified1 November 2016
SubmitterJubra
DownloadsMolfile
FormulaC13H20O6
Net Charge0
Average Mass272.297
Monoisotopic Mass272.12599
SMILESC=C(C(=O)O)C(CCCCCC(=O)OC)C(=O)OC
InChIInChI=1S/C13H20O6/c1-9(12(15)16)10(13(17)19-3)7-5-4-6-8-11(14)18-2/h10H,1,4-8H2,2-3H3,(H,15,16)
InChIKeyUYOJPIPBTQKANX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus niger (ncbitaxon:5061) - PubMed (17827758) Culture broth of Aspergillus niger FKI-2342 isolated from soil collected at Ooura Tensyudou, Nagasaki, Japan Strain: FKI-2342
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
Aspergillus metabolite  Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
ChEBI Ontology
Outgoing Relation(s)
tensyuic acid D (CHEBI:133830) has functional parent tensyuic acid B (CHEBI:133827)
tensyuic acid D (CHEBI:133830) has role Aspergillus metabolite (CHEBI:76956)
tensyuic acid D (CHEBI:133830) is a methyl ester (CHEBI:25248)
tensyuic acid D (CHEBI:133830) is a tensyuic acid (CHEBI:133873)
IUPAC Names 
(3Ξ)-9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acid
(3Ξ)-9-methoxy-3-(methoxycarbonyl)-2-methylene-9-oxononanoic acid
Synonyms  Source
(+)-9-methoxy-3-(methoxycarbonyl)-2-methylene-9-oxononanoic acidChEBI
(+)-9-methoxy-3-(methoxycarbonyl)-2-methylidene-9-oxononanoic acidChEBI
(+)-tensyuic acid DChEBI
Registry NumbersSources
Reaxys:11209669Reaxys
Citations