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CHEBI:226772 - Lactoquinomycin E

ChEBI IDCHEBI:226772
ChEBI NameLactoquinomycin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H25NO6
Net Charge0
Average Mass411.454
Monoisotopic Mass411.16819
SMILESCc1cc(O)cc2c1C(=O)c1c(ccc([C@H]3C[C@@H](N(C)C)[C@H](O)[C@@H](C)O3)c1O)C2=O
InChIInChI=1S/C23H25NO6/c1-10-7-12(25)8-15-18(10)23(29)19-14(21(15)27)6-5-13(22(19)28)17-9-16(24(3)4)20(26)11(2)30-17/h5-8,11,16-17,20,25-26,28H,9H2,1-4H3/t11-,16-,17-,20-/m1/s1
InChIKeyINOPVRVXCBNDBP-WCYMFGLZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tet.2019.05.060)
ChEBI Ontology
Outgoing Relation(s)
Lactoquinomycin E (CHEBI:226772) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
2-[(2R,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-1,6-dihydroxy-8-methylanthracene-9,10-dione
Manual XrefsDatabases
76712500ChemSpider