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CHEBI:174542 - Archangelin

ChEBI IDCHEBI:174542
ChEBI NameArchangelin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O4
Net Charge0
Average Mass338.403
Monoisotopic Mass338.15181
SMILESCC1=C(COc2c3ccoc3cc3oc(=O)ccc23)CCC(C)(C)C1
InChIInChI=1S/C21H22O4/c1-13-11-21(2,3)8-6-14(13)12-24-20-15-4-5-19(22)25-18(15)10-17-16(20)7-9-23-17/h4-5,7,9-10H,6,8,11-12H2,1-3H3
InChIKeyNETRCGJRLNZPCW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Archangelin (CHEBI:174542) is a psoralens (CHEBI:26369)
IUPAC Name 
4-[(2,4,4-trimethylcyclohexen-1-yl)methoxy]uro[3,2-g]chromen-7-one
Manual XrefsDatabases
154271ChemSpider
HMDB0030846HMDB
Registry NumbersSources
CAS:21174-75-4ChemIDplus