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CHEBI:209500 - Phomophyllin L

Default Structure
ChEBI IDCHEBI:209500
ChEBI NamePhomophyllin L
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O4
Net Charge0
Average Mass292.375
Monoisotopic Mass292.16746
SMILESCC(=O)OCCc1c(C)c(O)c2c(c1C)[C@@H](O)C(C)(C)C2
InChIInChI=1S/C17H24O4/c1-9-12(6-7-21-11(3)18)10(2)15(19)13-8-17(4,5)16(20)14(9)13/h16,19-20H,6-8H2,1-5H3/t16-/m1/s1
InChIKeyVIHHXDWCUWJCHV-MRXNPFEDSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - PubMed (29771527)
ChEBI Ontology
Outgoing Relation(s)
Phomophyllin L (CHEBI:209500) is a indanes (CHEBI:46940)
IUPAC Name 
2-[(3S)-3,7-dihydroxy-2,2,4,6-tetramethyl-1,3-dihydroinden-5-yl]ethyl acetate
Manual XrefsDatabases
78439071ChemSpider