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CHEBI:226374 - (3R)-4-(1,4-dihydroxy-5-methoxy-9,10-dioxoanthracen-2-yl)-3-hydroxy-3-methylbutanamide

ChEBI IDCHEBI:226374
ChEBI Name(3R)-4-(1,4-dihydroxy-5-methoxy-9,10-dioxoanthracen-2-yl)-3-hydroxy-3-methylbutanamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H19NO7
Net Charge0
Average Mass385.372
Monoisotopic Mass385.11615
SMILESCOc1cccc2c1C(=O)c1c(O)cc(C[C@@](C)(O)CC(N)=O)c(O)c1C2=O
InChIInChI=1S/C20H19NO7/c1-20(27,8-13(21)23)7-9-6-11(22)15-16(17(9)24)18(25)10-4-3-5-12(28-2)14(10)19(15)26/h3-6,22,24,27H,7-8H2,1-2H3,(H2,21,23)/t20-/m1/s1
InChIKeyBQUJZXPDECCLEJ-HXUWFJFHSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies QL37 (ncbitaxon:2093747) - PubMed (30656821)
ChEBI Ontology
Outgoing Relation(s)
(3R)-4-(1,4-dihydroxy-5-methoxy-9,10-dioxoanthracen-2-yl)-3-hydroxy-3-methylbutanamide (CHEBI:226374) is a anthraquinone (CHEBI:22580)
IUPAC Name 
(3R)-4-(1,4-dihydroxy-5-methoxy-9,10-dioxoanthracen-2-yl)-3-hydroxy-3-methylbutanamide