EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:220480 - Phomolide C

ChEBI IDCHEBI:220480
ChEBI NamePhomolide C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O6
Net Charge0
Average Mass342.432
Monoisotopic Mass342.20424
SMILESCCCCCCC1CCC2OC(=O)CCC(O)C(O)/C=C\C2(O)O1
InChIInChI=1S/C18H30O6/c1-2-3-4-5-6-13-7-9-16-18(22,24-13)12-11-15(20)14(19)8-10-17(21)23-16/h11-16,19-20,22H,2-10H2,1H3/b12-11-
InChIKeySUTLNXDRSYQRIT-QXMHVHEDSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - DOI (10.1016/s1875-5364(09)60032-7)
ChEBI Ontology
Outgoing Relation(s)
Phomolide C (CHEBI:220480) is a oxacycle (CHEBI:38104)
IUPAC Name 
(11Z)-2-hexyl-9,10,12a-trihydroxy-2,3,4,4a,7,8,9,10-octahydropyrano[3,2-b]oxecin-6-one
Manual XrefsDatabases
78444724ChemSpider