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CHEBI:215953 - Nigrosporin B

ChEBI IDCHEBI:215953
ChEBI NameNigrosporin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O7
Net Charge0
Average Mass320.297
Monoisotopic Mass320.08960
SMILESCOc1cc(O)c2c(c1O)C(=O)C1=C(C[C@H](O)[C@](C)(O)C1)C2=O
InChIInChI=1S/C16H16O7/c1-16(22)5-7-6(3-10(16)18)13(19)11-8(17)4-9(23-2)15(21)12(11)14(7)20/h4,10,17-18,21-22H,3,5H2,1-2H3/t10-,16+/m0/s1
InChIKeyIPVKWDJQQALEDL-MGPLVRAMSA-N
Species of MetaboliteComponentSourceComments
Nigrosporaspecies (ncbitaxon:1715238) - PubMed (27396737)
ChEBI Ontology
Outgoing Relation(s)
Nigrosporin B (CHEBI:215953) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(2S,3R)-2,3,5,8-tetrahydroxy-6-methoxy-3-methyl-2,4-dihydro-1H-anthracene-9,10-dione
Manual XrefsDatabases
78438103ChemSpider