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CHEBI:45301 - 4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN

Default Structure
ChEBI IDCHEBI:45301
ChEBI Name4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN
Stars
DownloadsMolfile
FormulaC15H14O4
Net Charge0
Average Mass258.273
Monoisotopic Mass258.08921
SMILES[H]OC([H])([H])c1c(C([H])([H])[H])oc2c(C([H])([H])[H])c3oc(=O)c([H])c(C([H])([H])[H])c3c([H])c12
InChIInChI=1S/C15H14O4/c1-7-4-13(17)19-14-8(2)15-11(5-10(7)14)12(6-16)9(3)18-15/h4-5,16H,6H2,1-3H3
InChIKeyRGJSDHXSAKMPNM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALEN (CHEBI:45301) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-(hydroxymethyl)-2,5,9-trimethyl-7H-furo[3,2-g]chromen-7-onePDBeChem
4'-HYDROXYMETHYL-4,5',8-TRIMETHYLPSORALENPDBeChem
Manual XrefsDatabases
PSOPDBeChem