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CHEBI:203666 - 7-(1-methyl-2-oxopropyl)streptonigrin

ChEBI IDCHEBI:203666
ChEBI Name7-(1-methyl-2-oxopropyl)streptonigrin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H28N4O9
Net Charge0
Average Mass576.562
Monoisotopic Mass576.18563
SMILESCOC1=C(NC(C)C(C)=O)C(=O)c2nc(-c3nc(C(=O)O)c(C)c(-c4ccc(OC)c(OC)c4O)c3N)ccc2C1=O
InChIInChI=1S/C29H28N4O9/c1-11-18(14-8-10-17(40-4)27(41-5)24(14)35)19(30)22(33-20(11)29(38)39)16-9-7-15-21(32-16)26(37)23(28(42-6)25(15)36)31-12(2)13(3)34/h7-10,12,31,35H,30H2,1-6H3,(H,38,39)
InChIKeyHYCLTZFHBHQLSE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (12027749)
ChEBI Ontology
Outgoing Relation(s)
7-(1-methyl-2-oxopropyl)streptonigrin (CHEBI:203666) is a bipyridines (CHEBI:50511)
IUPAC Name 
5-amino-4-(2-hydroxy-3,4-dimethoxyphenyl)-6-[6-methoxy-5,8-dioxo-7-(3-oxobutan-2-ylamino)quinolin-2-yl]-3-methylpyridine-2-carboxylic acid
Manual XrefsDatabases
10282224ChemSpider