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CHEBI:222201 - Saccharochelin E

ChEBI IDCHEBI:222201
ChEBI NameSaccharochelin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H61N7O11
Net Charge0
Average Mass743.900
Monoisotopic Mass743.44291
SMILESCCCCCCCCCCCCCC(=O)N[C@@H](CCCN(O)C=O)C(=O)N[C@@H](CO)C(=O)N(O)CCC[C@@H]1NC(=O)[C@H](CCCN(O)C=O)NC1=O
InChIInChI=1S/C34H61N7O11/c1-2-3-4-5-6-7-8-9-10-11-12-19-30(45)35-26(16-13-20-39(50)24-43)31(46)38-29(23-42)34(49)41(52)22-15-18-28-33(48)36-27(32(47)37-28)17-14-21-40(51)25-44/h24-29,42,50-52H,2-23H2,1H3,(H,35,45)(H,36,48)(H,37,47)(H,38,46)/t26-,27-,28-,29-/m0/s1
InChIKeyZEZMMLAWSYXXQV-DZUOILHNSA-N
Species of MetaboliteComponentSourceComments
Saccharothrix (ncbitaxon:2071) - PubMed (34323485)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Saccharochelin E (CHEBI:222201) is a dipeptide (CHEBI:46761)
IUPAC Name 
N-[(2S)-5-[ormyl(hydroxy)amino]-1-[[(2S)-1-[3-[(2S,5S)-5-[3-[ormyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]tetradecanamide