EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:211749 - Altersolanol J

ChEBI IDCHEBI:211749
ChEBI NameAltersolanol J
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O6
Net Charge0
Average Mass308.330
Monoisotopic Mass308.12599
SMILESCOc1cc(O)c2c(c1)C(=O)[C@H]1C[C@](C)(O)[C@H](O)C[C@@H]1[C@H]2O
InChIInChI=1S/C16H20O6/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/h3-4,8,10,12,15,17-18,20-21H,5-6H2,1-2H3/t8-,10-,12+,15+,16-/m0/s1
InChIKeyQJPIXVDUWUJAIT-YLHGYNODSA-N
Species of MetaboliteComponentSourceComments
Cladosporium (ncbitaxon:5498) - PubMed (12088431)
ChEBI Ontology
Outgoing Relation(s)
Altersolanol J (CHEBI:211749) is a anthracenes (CHEBI:46955)
IUPAC Name 
(2S,3R,4aS,9aS,10R)-2,3,5,10-tetrahydroxy-7-methoxy-2-methyl-1,3,4,4a,9a,10-hexahydroanthracen-9-one
Manual XrefsDatabases
9089113ChemSpider