EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:69273 - Inflatin D

ChEBI IDCHEBI:69273
ChEBI NameInflatin D
Stars
DefinitionA natural product found in Tolypocladium inflatum.
Last Modified11 May 2016
DownloadsMolfile
FormulaC22H26O9
Net Charge0
Average Mass434.441
Monoisotopic Mass434.15768
SMILES[H][C@@]1(O[C@@H]2O[C@@H](C)[C@@H](C)c3oc(=O)cc(OC)c32)O[C@@H](C)[C@@H](C)c2oc(=O)cc(OC)c21
InChIInChI=1S/C22H26O9/c1-9-11(3)27-21(17-13(25-5)7-15(23)29-19(9)17)31-22-18-14(26-6)8-16(24)30-20(18)10(2)12(4)28-22/h7-12,21-22H,1-6H3/t9-,10-,11+,12+,21+,22+/m1/s1
InChIKeyCGCDOVOCJQXOOK-QTTRIFOMSA-N
Species of MetaboliteComponentSourceComments
Tolypocladium inflatum (ncbitaxon:29910) - PubMed (21812410) Ethyl acetate extract, fungus isolated from soil on surface of fruiting bodies of Cordyceps sinensis
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Inflatin D (CHEBI:69273) has role metabolite (CHEBI:25212)
Inflatin D (CHEBI:69273) is a cyclic acetal (CHEBI:59770)
Inflatin D (CHEBI:69273) is a pyranopyranone (CHEBI:131901)
Synonym  Source
(5S,7S,8R)-4-methoxy-5-[[(5S,7S,8R)-4-methoxy-7,8-dimethyl-2-oxo-7,8-dihydro-5H-pyrano[4,3-b]pyran-5-yl]oxy]-7,8-dimethyl-7,8-dihydro-5H-pyrano[4,3-b]pyran-2-oneChEBI
Citations