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CHEBI:204665 - Dechloro-chaetomugilin A

ChEBI IDCHEBI:204665
ChEBI NameDechloro-chaetomugilin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H28O7
Net Charge0
Average Mass416.470
Monoisotopic Mass416.18350
SMILESC[C@H](/C=C/C1=CC2=CC(=O)[C@@]3(C)O[C@]4(O)[C@H](C)[C@@H](C)OC(=O)[C@@H]4[C@H]3C2=CO1)[C@@H](C)O
InChIInChI=1S/C23H28O7/c1-11(13(3)24)6-7-16-8-15-9-18(25)22(5)19(17(15)10-28-16)20-21(26)29-14(4)12(2)23(20,27)30-22/h6-14,19-20,24,27H,1-5H3/b7-6+/t11-,12-,13-,14-,19-,20+,22-,23-/m1/s1
InChIKeyFIRMJNKFPAFPLC-WKPSVYJBSA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (22617549)
ChEBI Ontology
Outgoing Relation(s)
Dechloro-chaetomugilin A (CHEBI:204665) is a δ-lactone (CHEBI:18946)
IUPAC Name 
(1S,10S,12R,13R,14R,17R)-12-hydroxy-5-[(E,3R,4R)-4-hydroxy-3-methylpent-1-enyl]-10,13,14-trimethyl-4,11,15-trioxatetracyclo[8.7.0.02,7.012,17]heptadeca-2,5,7-triene-9,16-dione
Manual XrefsDatabases
29214997ChemSpider