EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:212899 - Desferritriacetylfusigen-like antibiotic

ChEBI IDCHEBI:212899
ChEBI NameDesferritriacetylfusigen-like antibiotic
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H64N6O14
Net Charge0
Average Mass864.991
Monoisotopic Mass864.44805
SMILESCC(=O)NC1CCCN(O)C(=O)C=C(C)CCOC(=O)C(NC(C)=O)CCCN(C)C(=O)C=C(C)CCOC(=O)C(NC(C)=O)CCCN(O)C(=O)C=C(C)CCCOC1=O
InChIInChI=1S/C41H64N6O14/c1-27-12-11-21-59-39(54)34(43-31(5)49)14-9-20-47(58)38(53)26-29(3)17-23-61-40(55)33(42-30(4)48)13-8-18-45(7)36(51)24-28(2)16-22-60-41(56)35(44-32(6)50)15-10-19-46(57)37(52)25-27/h24-26,33-35,57-58H,8-23H2,1-7H3,(H,42,48)(H,43,49)(H,44,50)
InChIKeyQTOVLTRNLJCOCT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus nidulans (ncbitaxon:162425) - PubMed (363670)
ChEBI Ontology
Outgoing Relation(s)
Desferritriacetylfusigen-like antibiotic (CHEBI:212899) is a azamacrocycle (CHEBI:52898)
Desferritriacetylfusigen-like antibiotic (CHEBI:212899) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
N-(3,27-diacetamido-7,31-dihydroxy-10,19,22,34-tetramethyl-2,8,14,20,26,32-hexaoxo-1,13,25-trioxa-7,19,31-triazacycloheptatriaconta-9,21,33-trien-15-yl)acetamide