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CHEBI:200519 - Arromycin

ChEBI IDCHEBI:200519
ChEBI NameArromycin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O5
Net Charge0
Average Mass356.418
Monoisotopic Mass356.16237
SMILESCC1=C(CC2=C(O)c3c(cc(O)c(C)c3O)C(=O)C2=O)CCC(C)(C)C1
InChIInChI=1S/C21H24O5/c1-10-9-21(3,4)6-5-12(10)7-14-18(24)16-13(19(25)20(14)26)8-15(22)11(2)17(16)23/h8,22-24H,5-7,9H2,1-4H3
InChIKeyHFNSTSXXMAHKEJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Arromycin (CHEBI:200519) is a naphthoquinone (CHEBI:25481)
IUPAC Name 
4,5,7-trihydroxy-6-methyl-3-[(2,4,4-trimethylcyclohexen-1-yl)methyl]naphthalene-1,2-dione
Manual XrefsDatabases
78435935ChemSpider