CHEBI:15661 - (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid

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ChEBI Name (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid ChEBI ID CHEBI:15661 ChEBI ASCII Name (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid Definition The 2-(methoxycarbonylmethyl) derivative of fumaric acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:275, CHEBI:10947 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H8O6 Net Charge 0 Average Mass 188.13482 Monoisotopic Mass 188.03209 InChI InChI=1S/C7H8O6/c1-13-6(10)3-4(7(11)12)2-5(8)9/h2H,3H2,1H3,(H,8,9)(H,11,12)/b4-2+ InChIKey MRNZYUAGJLJQAM-DUXPYHPUSA-N SMILES COC(=O)C\C(=C/C(O)=O)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) has functional parent fumaric acid (CHEBI:18012) (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) is a dicarboxylic acid (CHEBI:35692) (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) is a fatty acid methyl ester (CHEBI:4986) (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) is a methyl ester (CHEBI:25248) (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) is conjugate acid of (2E)-2-(methoxycarbonylmethyl)but-2-enedioate(2−) (CHEBI:57469) Incoming (2E)-2-(methoxycarbonylmethyl)but-2-enedioate(2−) (CHEBI:57469) is conjugate base of (2E)-2-(methoxycarbonylmethyl)but-2-enedioic acid (CHEBI:15661) IUPAC Name (2E)-2-(2-methoxy-2-oxoethyl)but-2-enedioic acid Synonym Source (E)-2-(Methoxycarbonylmethyl)butenedioate KEGG COMPOUND Manual Xrefs Databases C11515 KEGG COMPOUND T8N PDBeChem View more database links Last Modified 24 February 2022