CHEBI:139267 - [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate

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ChEBI Name [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate ChEBI ID CHEBI:139267 ChEBI ASCII Name [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate Definition A butan-4-olide that is (5-oxooxolan-3-yl)methyl phosphate carrying an additional 6-methylheptanoyl substituent at position 4. Stars This entity has been manually annotated by the ChEBI Team. 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 C13H23O7P Net Charge 0 Average Mass 322.292 Monoisotopic Mass 322.11814 InChI InChI=1S/C13H23O7P/c1-9(2)5-3-4-6-11(14)12-10(7-19-13(12)15)8-20-21(16,17)18/h9-10,12H,3-8H2,1-2H3,(H2,16,17,18)/t10-,12?/m0/s1 InChIKey SVSJADIUUOOBST-NUHJPDEHSA-N SMILES [C@@H]1(C(C(OC1)=O)C(CCCCC(C)C)=O)COP(O)(=O)O Metabolite of Species Details Streptomyces griseus (NCBI:txid1911) See: PubMed Roles Classification Biological Role(s): bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria. View more via ChEBI Ontology ChEBI Ontology Outgoing [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) has role bacterial metabolite (CHEBI:76969) [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) is a β-ketoester (CHEBI:51849) [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) is a butan-4-olide (CHEBI:22950) [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) is a monoalkyl phosphate (CHEBI:25381) [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) is conjugate acid of [(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate(2−) (CHEBI:138605) Incoming [(3S,4R)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate(2−) (CHEBI:138605) is conjugate base of [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate (CHEBI:139267) IUPAC Name [(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl dihydrogen phosphate Manual Xref Database CPD-19888 MetaCyc View more database links Citation Type Source 17277085 PubMed citation Europe PMC Last Modified 08 December 2017