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CHEBI:224985 - Chaetomugilin M

ChEBI IDCHEBI:224985
ChEBI NameChaetomugilin M
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H27ClO7
Net Charge0
Average Mass450.915
Monoisotopic Mass450.14453
SMILESC[C@H](/C=C/C1=CC2=C(Cl)C(=O)[C@@]3(C)OC(=O)[C@@H](C(=O)[C@H](C)[C@@H](C)O)[C@H]3C2=CO1)[C@@H](C)O
InChIInChI=1S/C23H27ClO7/c1-10(12(3)25)6-7-14-8-15-16(9-30-14)18-17(20(27)11(2)13(4)26)22(29)31-23(18,5)21(28)19(15)24/h6-13,17-18,25-26H,1-5H3/b7-6+/t10-,11-,12-,13-,17-,18-,23+/m1/s1
InChIKeyMEPQPODJTXSHEP-MGAKCBRVSA-N
Species of MetaboliteComponentSourceComments
Chaetomium globosum (ncbitaxon:38033) - DOI (10.1016/j.tet.2009.06.125)
ChEBI Ontology
Outgoing Relation(s)
Chaetomugilin M (CHEBI:224985) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(6aS,9R,9aS)-5-chloro-9-[(2R,3R)-3-hydroxy-2-methylbutanoyl]-3-[(E,3R,4R)-4-hydroxy-3-methylpent-1-enyl]-6a-methyl-9,9a-dihydrouro[2,3-h]isochromene-6,8-dione
Manual XrefsDatabases
27024231ChemSpider