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CHEBI:222495 - Provipeptide B

ChEBI IDCHEBI:222495
ChEBI NameProvipeptide B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H34N4O4
Net Charge0
Average Mass454.571
Monoisotopic Mass454.25801
SMILESCCC(C)C1NC(=O)C2CCCN2C(=O)C(Cc2ccccc2)NC(=O)C2CCCN2C1=O
InChIInChI=1S/C25H34N4O4/c1-3-16(2)21-25(33)29-14-8-11-19(29)22(30)26-18(15-17-9-5-4-6-10-17)24(32)28-13-7-12-20(28)23(31)27-21/h4-6,9-10,16,18-21H,3,7-8,11-15H2,1-2H3,(H,26,30)(H,27,31)
InChIKeyVRGZEVRHLKTHMF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31243345)
ChEBI Ontology
Outgoing Relation(s)
Provipeptide B (CHEBI:222495) has functional parent α-amino acid (CHEBI:33704)
Provipeptide B (CHEBI:222495) is a organonitrogen compound (CHEBI:35352)
Provipeptide B (CHEBI:222495) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
3-benzyl-12-butan-2-yl-1,4,10,13-tetrazatricyclo[13.3.0.06,10]octadecane-2,5,11,14-tetrone
Manual XrefsDatabases
78315787ChemSpider