CHEBI:133827 - tensyuic acid B

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ChEBI Name tensyuic acid B
ChEBI ID CHEBI:133827
Definition A tensyuic acid that is itaconic acid which has been substituted at position 3 by a 5-(methoxycarbonyl)pentyl group. The (−)-isomer, isolated from Aspergillus niger FKI-2342.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Julian Brandl
Supplier Information
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Formula C12H18O6
Net Charge 0
Average Mass 258.268
Monoisotopic Mass 258.11034
InChI InChI=1S/C12H18O6/c1-8(11(14)15)9(12(16)17)6-4-3-5-7-10(13)18-2/h9H,1,3-7H2,2H3,(H,14,15)(H,16,17)
InChIKey ZMTXIFCPSXJBPW-UHFFFAOYSA-N
SMILES C(CCC(C(=C)C(O)=O)C(O)=O)CCC(OC)=O
Metabolite of Species Details
Aspergillus niger (NCBI:txid5061) Culture broth of Aspergillus niger FKI-2342 isolated from soil collected at Ooura Tensyudou, Nagasaki, Japan of strain FKI-2342 See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tensyuic acid B (CHEBI:133827) has role Aspergillus metabolite (CHEBI:76956)
tensyuic acid B (CHEBI:133827) is a dicarboxylic acid (CHEBI:35692)
tensyuic acid B (CHEBI:133827) is a methyl ester (CHEBI:25248)
tensyuic acid B (CHEBI:133827) is a tensyuic acid (CHEBI:133873)
Incoming tensyuic acid D (CHEBI:133830) has functional parent tensyuic acid B (CHEBI:133827)
IUPAC Names
(2Ξ)-2-(6-methoxy-6-oxohexyl)-3-methylenesuccinic acid
(2Ξ)-2-(6-methoxy-6-oxohexyl)-3-methylidenebutanedioic acid
Synonyms Sources
(−)-2-(6-methoxy-6-oxohexyl)-3-methylenesuccinic acid ChEBI
(−)-2-(6-methoxy-6-oxohexyl)-3-methylidenebutanedioic acid ChEBI
(−)-tensyuic acid B ChEBI
Registry Number Type Source
11209667 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
17827758 PubMed citation Europe PMC
Last Modified
01 November 2016