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CHEBI:219628 - Brevianamide D

ChEBI IDCHEBI:219628
ChEBI NameBrevianamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H23N3O3
Net Charge0
Average Mass365.433
Monoisotopic Mass365.17394
SMILESCC(C)[C@@H]1CC2(/C=C3/Nc4ccccc4C3=O)NC(=O)C13CCCN3C2=O
InChIInChI=1S/C21H23N3O3/c1-12(2)14-10-20(11-16-17(25)13-6-3-4-7-15(13)22-16)19(27)24-9-5-8-21(14,24)18(26)23-20/h3-4,6-7,11-12,14,22H,5,8-10H2,1-2H3,(H,23,26)/b16-11+/t14-,20?,21?/m0/s1
InChIKeyVUYPQWOUMOQTJW-PBPZTOGNSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/0040-4020(72)80014-0)
ChEBI Ontology
Outgoing Relation(s)
Brevianamide D (CHEBI:219628) has functional parent α-amino acid (CHEBI:33704)
Brevianamide D (CHEBI:219628) is a organonitrogen compound (CHEBI:35352)
Brevianamide D (CHEBI:219628) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(10S)-7-[(E)-(3-oxo-1H-indol-2-ylidene)methyl]-10-propan-2-yl-5,8-diazatricyclo[5.2.2.01,5]undecane-6,9-dione
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58817138ChemSpider