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CHEBI:220603 - gamma-iso-Rubromycin

ChEBI IDCHEBI:220603
ChEBI Namegamma-iso-Rubromycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H16O8
Net Charge0
Average Mass444.395
Monoisotopic Mass444.08452
SMILESCC(=O)c1cc2cc(CCc3cc4c(o3)C(=O)c3ccccc3C4=O)c(O)c(O)c2c(=O)o1
InChIInChI=1S/C25H16O8/c1-11(26)18-9-13-8-12(20(27)23(30)19(13)25(31)33-18)6-7-14-10-17-21(28)15-4-2-3-5-16(15)22(29)24(17)32-14/h2-5,8-10,27,30H,6-7H2,1H3
InChIKeyCNCUCHMIDJODTO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces collinus (ncbitaxon:42684) - PubMed (25855820)
ChEBI Ontology
Outgoing Relation(s)
gamma-iso-Rubromycin (CHEBI:220603) is a naphthofuran (CHEBI:39270)
IUPAC Name 
2-[2-(3-acetyl-7,8-dihydroxy-1-oxoisochromen-6-yl)ethyl]benzo[][1]benzouran-4,9-dione
Manual XrefsDatabases
78435161ChemSpider