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CHEBI:175944 - MAB 4

ChEBI IDCHEBI:175944
ChEBI NameMAB 4
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FormulaC22H28O6
Net Charge0
Average Mass388.460
Monoisotopic Mass388.18859
SMILESCCCc1cc(=O)oc2c3c(c(C(=O)C(C)CC)c(O)c12)OC(C(C)(C)O)C3
InChIInChI=1S/C22H28O6/c1-6-8-12-9-15(23)28-20-13-10-14(22(4,5)26)27-21(13)17(19(25)16(12)20)18(24)11(3)7-2/h9,11,14,25-26H,6-8,10H2,1-5H3
InChIKeyKTJYLXIAFCVVBF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
MAB 4 (CHEBI:175944) is a furanocoumarin (CHEBI:24128)
IUPAC Name 
5-hydroxy-8-(2-hydroxypropan-2-yl)-6-(2-methylbutanoyl)-4-propyl-8,9-dihydrouro[2,3-h]chromen-2-one
Manual XrefsDatabases
35013259ChemSpider
HMDB0030715HMDB