CHEBI:205712 - Minioluteumide A

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Minioluteumide A
ChEBI ID CHEBI:205712
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H32ClNO5
Net Charge 0
Average Mass 425.950
Monoisotopic Mass 425.19690
InChI InChI=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
InChIKey DCQKNTFSXKCQSC-GZOXUXNESA-N
SMILES Cl[C@H]1C=2C(=O)OCC2[C@]3([C@@H](OC(=O)[C@@H](NC(=O)C)C(C)C)CCC([C@@H]3C1)(C)C)C
Metabolite of Species Details
Talaromyces minioluteus (NCBI:txid28574) See: PubMed
ChEBI Ontology
Outgoing 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
Manual Xref Database
35517057 ChemSpider
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