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CHEBI:200577 - Applanatumol T

ChEBI IDCHEBI:200577
ChEBI NameApplanatumol T
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18O7
Net Charge0
Average Mass322.313
Monoisotopic Mass322.10525
SMILESC/C(=C\CC[C@H](CC(=O)c1cc(O)ccc1O)C(=O)O)C(=O)O
InChIInChI=1S/C16H18O7/c1-9(15(20)21)3-2-4-10(16(22)23)7-14(19)12-8-11(17)5-6-13(12)18/h3,5-6,8,10,17-18H,2,4,7H2,1H3,(H,20,21)(H,22,23)/b9-3+/t10-/m1/s1
InChIKeyAXGVFLQALSABLQ-OTVCUZDGSA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - DOI (10.1016/j.tet.2016.06.019)
ChEBI Ontology
Outgoing Relation(s)
Applanatumol T (CHEBI:200577) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(E,6R)-6-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-2-methylhept-2-enedioic acid
Manual XrefsDatabases
78440830ChemSpider