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CHEBI:189272 - Rhodopeptin C1

ChEBI IDCHEBI:189272
ChEBI NameRhodopeptin C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H47N5O4
Net Charge0
Average Mass481.682
Monoisotopic Mass481.36280
SMILESCCC(C)CCCCCCC1CC(=O)NCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](C(C)C)C(=O)N1
InChIInChI=1S/C25H47N5O4/c1-5-18(4)11-8-6-7-9-12-19-15-21(31)27-16-22(32)29-20(13-10-14-26)24(33)30-23(17(2)3)25(34)28-19/h17-20,23H,5-16,26H2,1-4H3,(H,27,31)(H,28,34)(H,29,32)(H,30,33)/t18?,19?,20-,23-/m0/s1
InChIKeyBCORRXOGBNOQQU-NWEKGRFWSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
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 C1 (CHEBI:189272) is a cyclic peptide (CHEBI:23449)
IUPAC Names 
(3S,6S)-6-(3-aminopropyl)-13-(7-methylnonyl)-3-propan-2-yl-1,4,7,10-tetrazacyclotridecane-2,5,8,11-tetrone
(3S,6S,13R)-6-(3-aminopropyl)-13-(7-methylnonyl)-3-propan-2-yl-1,4,7,10-tetrazacyclotridecane-2,5,8,11-tetrone
Manual XrefsDatabases
425254ChemSpider
78436327ChemSpider