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CHEBI:205963 - Rhodopeptin B5

ChEBI IDCHEBI:205963
ChEBI NameRhodopeptin B5
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H53N5O4
Net Charge0
Average Mass523.763
Monoisotopic Mass523.40976
SMILESCC(C)CCCCCCCCC[C@@H]1CC(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N1
InChIInChI=1S/C28H53N5O4/c1-20(2)14-10-8-6-5-7-9-11-15-22-18-24(34)30-19-25(35)32-23(16-12-13-17-29)27(36)33-26(21(3)4)28(37)31-22/h20-23,26H,5-19,29H2,1-4H3,(H,30,34)(H,31,37)(H,32,35)(H,33,36)/t22-,23+,26+/m1/s1
InChIKeyCQVSTNLAGJAEKO-UMFSSWHCSA-N
Species of MetaboliteComponentSourceComments
Rhodococcus (ncbitaxon:1827) - PubMed (10580383)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Rhodopeptin B5 (CHEBI:205963) is a cyclic peptide (CHEBI:23449)
IUPAC Name 
(3S,6S,13R)-6-(4-aminobutyl)-13-(10-methylundecyl)-3-propan-2-yl-1,4,7,10-tetrazacyclotridecane-2,5,8,11-tetrone
Manual XrefsDatabases
78438396ChemSpider