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CHEBI:192737 - Aeruclynamide D

ChEBI IDCHEBI:192737
ChEBI NameAeruclynamide D
Stars
Submittermwilliams
DownloadsMolfile
FormulaC26H30N6O4S3
Net Charge0
Average Mass586.765
Monoisotopic Mass586.14907
SMILESCSCCC1NC(=O)c2csc(n2)CNC(=O)C2N=C(OC2C)C(Cc2ccccc2)NC(=O)C2CSC1=N2
InChIInChI=1S/C26H30N6O4S3/c1-14-21-24(35)27-11-20-28-18(12-38-20)22(33)29-16(8-9-37-2)26-31-19(13-39-26)23(34)30-17(25(32-21)36-14)10-15-6-4-3-5-7-15/h3-7,12,14,16-17,19,21H,8-11,13H2,1-2H3,(H,27,35)(H,29,33)(H,30,34)
InChIKeyMLBROOJXUZKDHY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus fumigatus Af293 (ncbitaxon:330879) Whole Organism (NCIT:C13413) MetaboLights (MTBLS5072)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Aeruclynamide D (CHEBI:192737) is a cyclic peptide (CHEBI:23449)