CHEBI:210984 - Brevianamide V

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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 Brevianamide V
ChEBI ID CHEBI:210984
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C21H23N3O2
Net Charge 0
Average Mass 349.434
Monoisotopic Mass 349.17903
InChI InChI=1S/C21H23N3O2/c1-4-21(2,3)18-14(13-8-5-6-9-15(13)22-18)12-16-20(26)24-11-7-10-17(24)19(25)23-16/h4-6,8-9,12,17,22H,1,7,10-11H2,2-3H3,(H,23,25)/b16-12-/t17-/m0/s1
InChIKey OLIPWSSLWWMAAT-WBILKINKSA-N
SMILES O=C/1N2[C@H](C(=O)N\C1=C/C=3C4=C(C=CC=C4)NC3C(C=C)(C)C)CCC2
Metabolite of Species Details
Aspergillus versicolor (NCBI:txid46472) See: PubMed
ChEBI Ontology
Outgoing Brevianamide V (CHEBI:210984) has functional parent α-amino acid (CHEBI:33704)
Brevianamide V (CHEBI:210984) is a organonitrogen compound (CHEBI:35352)
Brevianamide V (CHEBI:210984) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3Z,8aS)-3-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazine-1,4-dione
Manual Xref Database
29215247 ChemSpider
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