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CHEBI:205712 - Minioluteumide A

ChEBI IDCHEBI:205712
ChEBI NameMinioluteumide A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32ClNO5
Net Charge0
Average Mass425.953
Monoisotopic Mass425.19690
SMILESCC(=O)N[C@H](C(=O)O[C@H]1CCC(C)(C)[C@@H]2C[C@@H](Cl)C3=C(COC3=O)[C@@]12C)C(C)C
InChIInChI=1S/C22H32ClNO5/c1-11(2)18(24-12(3)25)20(27)29-16-7-8-21(4,5)15-9-14(23)17-13(22(15,16)6)10-28-19(17)26/h11,14-16,18H,7-10H2,1-6H3,(H,24,25)/t14-,15+,16+,18+,22-/m1/s1
InChIKeyDCQKNTFSXKCQSC-GZOXUXNESA-N
Species of MetaboliteComponentSourceComments
Talaromyces minioluteus (ncbitaxon:28574) - PubMed (26058010)
ChEBI Ontology
Outgoing Relation(s)
Minioluteumide A (CHEBI:205712) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(4R,5aS,9S,9aS)-4-chloro-6,6,9a-trimethyl-3-oxo-4,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzouran-9-yl] (2S)-2-acetamido-3-methylbutanoate
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35517057ChemSpider