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CHEBI:213716 - Brasiliamide H

ChEBI IDCHEBI:213716
ChEBI NameBrasiliamide H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26N2O6
Net Charge0
Average Mass438.480
Monoisotopic Mass438.17909
SMILESCOc1cc([C@H](O)[C@]23CN(C(C)=O)[C@H](CN2C(C)=O)C3c2ccccc2)cc2c1OCO2
InChIInChI=1S/C24H26N2O6/c1-14(27)25-12-24(23(29)17-9-19(30-3)22-20(10-17)31-13-32-22)21(16-7-5-4-6-8-16)18(25)11-26(24)15(2)28/h4-10,18,21,23,29H,11-13H2,1-3H3/t18-,21?,23+,24-/m1/s1
InChIKeyRZSVOZPQFSKXTP-AWHBAWNFSA-N
Species of MetaboliteComponentSourceComments
Aspergillus hiratsukae (ncbitaxon:1194566) - PubMed (31982554)
ChEBI Ontology
Outgoing Relation(s)
Brasiliamide H (CHEBI:213716) is a pyrrolidines (CHEBI:38260)
IUPAC Name 
1-[(1S,4S)-5-acetyl-1-[(S)-hydroxy-(7-methoxy-1,3-benzodioxol-5-yl)methyl]-7-phenyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethanone