EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:210757 - Tetrahydroaltersolanol C

ChEBI IDCHEBI:210757
ChEBI NameTetrahydroaltersolanol C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O6
Net Charge0
Average Mass308.330
Monoisotopic Mass308.12599
SMILESCOc1cc(O)c2c(c1)[C@@H](O)[C@H]1C[C@](C)(O)[C@H](O)C[C@@H]1C2=O
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/h3-4,8,10,12,14,17-19,21H,5-6H2,1-2H3/t8-,10-,12+,14+,16-/m0/s1
InChIKeyGYPNJHLHXZTDFI-FMFJDBFUSA-N
Species of MetaboliteComponentSourceComments
Alternariaspecies ZJ-2008003 (ncbitaxon:1081808) - PubMed (22276679)
ChEBI Ontology
Outgoing Relation(s)
Tetrahydroaltersolanol C (CHEBI:210757) is a anthracenes (CHEBI:46955)
IUPAC Name 
(2R,3S,4aS,9aS,10S)-2,3,8,10-tetrahydroxy-6-methoxy-3-methyl-1,2,4,4a,9a,10-hexahydroanthracen-9-one
Manual XrefsDatabases
28504329ChemSpider