CHEBI:220603 - gamma-iso-Rubromycin

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name gamma-iso-Rubromycin
ChEBI ID CHEBI:220603
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H16O8
Net Charge 0
Average Mass 444.395
Monoisotopic Mass 444.08452
InChI InChI=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
InChIKey CNCUCHMIDJODTO-UHFFFAOYSA-N
SMILES O=C1OC(C(=O)C)=CC=2C1=C(O)C(O)=C(CCC=3OC=4C(=O)C=5C=CC=CC5C(C4C3)=O)C2
Metabolite of Species Details
Streptomyces collinus (NCBI:txid42684) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
78435161 ChemSpider
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