EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:206561 - (+/-)-aspergilol G

ChEBI IDCHEBI:206561
ChEBI Name(+/-)-aspergilol G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H32O9
Net Charge0
Average Mass584.621
Monoisotopic Mass584.20463
SMILESCCCCC[C@@H](c1c(O)cc(C)cc1Oc1cc(C)cc(O)c1)c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O
InChIInChI=1S/C34H32O9/c1-4-5-6-7-21(28-24(37)10-17(3)11-27(28)43-20-9-16(2)8-18(35)12-20)29-26(39)15-23-31(33(29)41)34(42)30-22(32(23)40)13-19(36)14-25(30)38/h8-15,21,35-39,41H,4-7H2,1-3H3/t21-/m0/s1
InChIKeyQZGMTHOISBJTPV-NRFANRHFSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (28129981)
ChEBI Ontology
Outgoing Relation(s)
(+/-)-aspergilol G (CHEBI:206561) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
1,3,6,8-tetrahydroxy-2-[1-[2-hydroxy-6-(3-hydroxy-5-methylphenoxy)-4-methylphenyl]hexyl]anthracene-9,10-dione
Manual XrefsDatabases
61362073ChemSpider