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CHEBI:222185 - Saccharochelin B

ChEBI IDCHEBI:222185
ChEBI NameSaccharochelin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H57N7O11
Net Charge0
Average Mass715.846
Monoisotopic Mass715.41161
SMILESCC(C)CCCCCCCCC(=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/C32H57N7O11/c1-23(2)12-7-5-3-4-6-8-16-28(43)33-24(13-9-17-37(48)21-41)29(44)36-27(20-40)32(47)39(50)19-11-15-26-31(46)34-25(30(45)35-26)14-10-18-38(49)22-42/h21-27,40,48-50H,3-20H2,1-2H3,(H,33,43)(H,34,46)(H,35,45)(H,36,44)/t24-,25-,26-,27-/m0/s1
InChIKeyLZVVUUWVABZKAU-FWEHEUNISA-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 B (CHEBI:222185) 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]-10-methylundecanamide