[4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate (CHEBI:197420)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	[4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate

ChEBI ID	CHEBI:197420

Definition	Major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C16H19O5

Net Charge

-1

Average Mass

291.324

Monoisotopic Mass

291.12380

InChI

InChI=1S/C16H20O5/c1-2-3-4-5-6-7-8-9-10-12-13(11-14(17)18)16(20)21-15(12)19/h2-3,9-10H,4-8,11H2,1H3,(H,17,18)/p-1/b3-2+,10-9+

InChIKey

LIFIIRLVOKVXIZ-SCIPBJTFSA-M

SMILES

O1C(C(=C(C1=O)CC([O-])=O)/C=C/CCCCC/C=C/C)=O

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	[4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate (CHEBI:197420) is a cyclic dicarboxylic anhydride (CHEBI:36609) [4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate (CHEBI:197420) is a dioxo monocarboxylic acid (CHEBI:35951) [4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate (CHEBI:197420) is a furans (CHEBI:24129)

Synonym	Source
[4-(deca-1,8-diyl)-2,5-dioxo-2,5-dihydro-3-furanyl]acetate	UniProt

Citation	Type	Source
26558485	PubMed citation	SUBMITTER