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CHEBI:198822 - 4-dehydroxyaltersolanol A

ChEBI IDCHEBI:198822
ChEBI Name4-dehydroxyaltersolanol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O7
Net Charge0
Average Mass320.297
Monoisotopic Mass320.08960
SMILESCOc1cc(O)c2c(c1)C(=O)C1=C(C2=O)[C@H](O)[C@@H](O)[C@@](C)(O)C1
InChIInChI=1S/C16H16O7/c1-16(22)5-8-11(14(20)15(16)21)13(19)10-7(12(8)18)3-6(23-2)4-9(10)17/h3-4,14-15,17,20-22H,5H2,1-2H3/t14-,15+,16-/m0/s1
InChIKeyLWVJBIHQFDYBOY-XHSDSOJGSA-N
Species of MetaboliteComponentSourceComments
Nigrospora oryzae (ncbitaxon:335854) - PubMed (26136060)
ChEBI Ontology
Outgoing Relation(s)
4-dehydroxyaltersolanol A (CHEBI:198822) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(1S,2R,3S)-1,2,3,8-tetrahydroxy-6-methoxy-3-methyl-2,4-dihydro-1H-anthracene-9,10-dione
Manual XrefsDatabases
78441975ChemSpider