EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:198049 - (3S),(6R)-6-hydroxylasiodiplodin

ChEBI IDCHEBI:198049
ChEBI Name(3S),(6R)-6-hydroxylasiodiplodin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O5
Net Charge0
Average Mass308.374
Monoisotopic Mass308.16237
SMILESCOc1cc(O)cc2c1C(=O)O[C@@H](C)CC[C@H](O)CCCC2
InChIInChI=1S/C17H24O5/c1-11-7-8-13(18)6-4-3-5-12-9-14(19)10-15(21-2)16(12)17(20)22-11/h9-11,13,18-19H,3-8H2,1-2H3/t11-,13+/m0/s1
InChIKeyDGMDZTUKWDQSTB-WCQYABFASA-N
Species of MetaboliteComponentSourceComments
Sarocladium kiliense (ncbitaxon:45277) - PubMed (23449205)
ChEBI Ontology
Outgoing Relation(s)
(3S),(6R)-6-hydroxylasiodiplodin (CHEBI:198049) is a macrolide (CHEBI:25106)
IUPAC Name 
(4S,7R)-7,14-dihydroxy-16-methoxy-4-methyl-3-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-2-one
Manual XrefsDatabases
78439573ChemSpider