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CHEBI:202614 - Quinofuracin A

ChEBI IDCHEBI:202614
ChEBI NameQuinofuracin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H30O12
Net Charge0
Average Mass534.514
Monoisotopic Mass534.17373
SMILESCCCCC[C@H](O[C@@H]1O[C@@H]([C@H](O)CO)[C@H](O)[C@H]1O)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C26H30O12/c1-2-3-4-5-16(37-26-24(36)23(35)25(38-26)15(31)9-27)19-14(30)8-12-18(22(19)34)21(33)17-11(20(12)32)6-10(28)7-13(17)29/h6-8,15-16,23-31,34-36H,2-5,9H2,1H3/t15-,16+,23-,24-,25+,26-/m1/s1
InChIKeyUDEJSRNTKLJXPT-HQUGCNLOSA-N
Species of MetaboliteComponentSourceComments
Staphylotrichum (ncbitaxon:370954) - PubMed (25611347)
ChEBI Ontology
Outgoing Relation(s)
Quinofuracin A (CHEBI:202614) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2-[(1S)-1-[(2R,3R,4R,5S)-5-[(1R)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxyhexyl]-1,3,6,8-tetrahydroxyanthracene-9,10-dione
Manual XrefsDatabases
58986410ChemSpider