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CHEBI:174637 - 5-De-O-methyltoddanol

Default Structure
ChEBI IDCHEBI:174637
ChEBI Name5-De-O-methyltoddanol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O5
Net Charge0
Average Mass276.288
Monoisotopic Mass276.09977
SMILESC=C(C)C(O)Cc1c(OC)cc2oc(=O)ccc2c1O
InChIInChI=1S/C15H16O5/c1-8(2)11(16)6-10-12(19-3)7-13-9(15(10)18)4-5-14(17)20-13/h4-5,7,11,16,18H,1,6H2,2-3H3
InChIKeyLMUSYGSJXWROBU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-De-O-methyltoddanol (CHEBI:174637) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
5-hydroxy-6-(2-hydroxy-3-methylbut-3-enyl)-7-methoxychromen-2-one
Manual XrefsDatabases
35015195ChemSpider
HMDB0041520HMDB