CHEBI:138604 - [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2−)

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ChEBI Name [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2−) ChEBI ID CHEBI:138604 ChEBI ASCII Name [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2-) Definition A (4-alkanoyl-5-oxo-2,5-dihydrofuran-3-yl)methyl phosphate(2−) obtained by deprotonation of the phosphate OH groups of [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen 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 C13H19O7P Net Charge -2 Average Mass 318.260 Monoisotopic Mass 318.08794 InChI InChI=1S/C13H21O7P/c1-9(2)5-3-4-6-11(14)12-10(7-19-13(12)15)8-20-21(16,17)18/h9H,3-8H2,1-2H3,(H2,16,17,18)/p-2 InChIKey YBTPRHSACHYWOV-UHFFFAOYSA-L SMILES C1(=C(C(OC1)=O)C(CCCCC(C)C)=O)COP([O-])(=O)[O-] ChEBI Ontology Outgoing [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2−) (CHEBI:138604) is a (4-alkanoyl-5-oxo-2,5-dihydrofuran-3-yl)methyl phosphate(2−) (CHEBI:138603) [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2−) (CHEBI:138604) is conjugate base of [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate (CHEBI:139248) Incoming [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate (CHEBI:139248) is conjugate acid of [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate(2−) (CHEBI:138604) IUPAC Name [4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate Synonym Source [4-(6-methylheptanoyl)-5-oxo-2H-furan-3-yl]methyl phosphate UniProt Manual Xref Database CPD-19889 MetaCyc View more database links Citation Type Source 17277085 PubMed citation SUBMITTER Last Modified 07 December 2017