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CHEBI:224288 - Proversilin E

ChEBI IDCHEBI:224288
ChEBI NameProversilin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H31NO6
Net Charge0
Average Mass453.535
Monoisotopic Mass453.21514
SMILESCC(=O)N[C@H](CC(=O)O[C@@H]1C[C@](C)(C=O)[C@@H]2CCC3=C(COC3=O)[C@@]2(C)C1)c1ccccc1
InChIInChI=1S/C26H31NO6/c1-16(29)27-21(17-7-5-4-6-8-17)11-23(30)33-18-12-25(2,15-28)22-10-9-19-20(14-32-24(19)31)26(22,3)13-18/h4-8,15,18,21-22H,9-14H2,1-3H3,(H,27,29)/t18-,21-,22+,25-,26-/m1/s1
InChIKeyFOXAXXSSZVCTNS-TWGVXTRVSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (32628478)
ChEBI Ontology
Outgoing Relation(s)
Proversilin E (CHEBI:224288) is a naphthofuran (CHEBI:39270)
IUPAC Name 
[(5aR,6S,8S,9aS)-6-ormyl-6,9a-dimethyl-3-oxo-4,5,5a,7,8,9-hexahydro-1H-benzo[e][2]benzouran-8-yl] (3R)-3-acetamido-3-phenylpropanoate
Manual XrefsDatabases
113385664ChemSpider