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CHEBI:210724 - (2S,4S)-globoscinic acid

ChEBI IDCHEBI:210724
ChEBI Name(2S,4S)-globoscinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18O7
Net Charge0
Average Mass298.291
Monoisotopic Mass298.10525
SMILESCO[C@@H](C[C@H](O)c1c(O)c(C)cc(C(C)=O)c1O)C(=O)O
InChIInChI=1S/C14H18O7/c1-6-4-8(7(2)15)13(18)11(12(6)17)9(16)5-10(21-3)14(19)20/h4,9-10,16-18H,5H2,1-3H3,(H,19,20)/t9-,10-/m0/s1
InChIKeyWTTHPSZUSQNYFG-UWVGGRQHSA-N
Species of MetaboliteComponentSourceComments
Xylaria globosa (ncbitaxon:323541) - DOI (10.1039/p19950002067)
ChEBI Ontology
Outgoing Relation(s)
(2S,4S)-globoscinic acid (CHEBI:210724) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(2S,4S)-4-(3-acetyl-2,6-dihydroxy-5-methylphenyl)-4-hydroxy-2-methoxybutanoic acid
Manual XrefsDatabases
8261566ChemSpider