EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:198293 - Dihydroaltersolanol B

ChEBI IDCHEBI:198293
ChEBI NameDihydroaltersolanol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18O6
Net Charge0
Average Mass306.314
Monoisotopic Mass306.11034
SMILESCOc1cc(O)c2c(c1)C(=O)[C@H]1C[C@](C)(O)[C@H](O)C[C@@H]1C2=O
InChIInChI=1S/C16H18O6/c1-16(21)6-10-8(5-12(16)18)15(20)13-9(14(10)19)3-7(22-2)4-11(13)17/h3-4,8,10,12,17-18,21H,5-6H2,1-2H3/t8-,10-,12+,16-/m0/s1
InChIKeyLTGSEZGUXURGDR-SLLFNTCVSA-N
Species of MetaboliteComponentSourceComments
Stemphylium globuliferum (ncbitaxon:245170) - DOI (10.1002/ejoc.201500079)
ChEBI Ontology
Outgoing Relation(s)
Dihydroaltersolanol B (CHEBI:198293) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(2R,3S,4aS,9aS)-2,3,8-trihydroxy-6-methoxy-3-methyl-2,4,4a,9a-tetrahydro-1H-anthracene-9,10-dione
Manual XrefsDatabases
78436339ChemSpider