EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:211775 - Miniolutelide B

ChEBI IDCHEBI:211775
ChEBI NameMiniolutelide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H32O10
Net Charge0
Average Mass504.532
Monoisotopic Mass504.19955
SMILESCOC(=O)[C@@]12[C@@]3(C)[C@H]4C=C5C(=CC(=O)OC5(C)C)[C@H](C)[C@@H]3C[C@@]3(C)C(=O)O[C@@H](O[C@@H](C)[C@@]1(O)O4)[C@@]23O
InChIInChI=1S/C26H32O10/c1-11-13-8-17(27)36-21(3,4)14(13)9-16-23(6)15(11)10-22(5)18(28)34-20-25(22,30)24(23,19(29)32-7)26(31,35-16)12(2)33-20/h8-9,11-12,15-16,20,30-31H,10H2,1-7H3/t11-,12-,15-,16+,20+,22-,23+,24-,25-,26+/m0/s1
InChIKeyHDEUKSXFAHLYFI-MJGKHECUSA-N
Species of MetaboliteComponentSourceComments
Talaromyces minioluteus (ncbitaxon:28574) - PubMed (18237180)
ChEBI Ontology
Outgoing Relation(s)
Miniolutelide B (CHEBI:211775) is a furopyran (CHEBI:74927)
IUPAC Name 
methyl (1S,2R,10R,12S,13S,15R,18R,19S,20R,21S)-12,19-dihydroxy-2,7,7,13,18,21-hexamethyl-5,17-dioxo-6,11,14,16-tetraoxahexacyclo[16.3.1.03,8.010,21.012,20.015,19]docosa-3,8-diene-20-carboxylate
Manual XrefsDatabases
78438529ChemSpider