EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:65822 - EI-1511-3

ChEBI IDCHEBI:65822
ChEBI NameEI-1511-3
Stars
DefinitionA polyene antibiotic isolated from the fermentation broth of Streptomyces sp.E-1625 that exhibits inhibitory activity towards the recombinant human interleukin-1β converting enzyme (ICE). It also shows weak antibacterial activity against strains like Enterococcus faecium, Staphylococcus aureus and Bacillus subtilis.
Last Modified7 March 2018
DownloadsMolfile
FormulaC27H30N2O7
Net Charge0
Average Mass494.544
Monoisotopic Mass494.20530
SMILES[H][C@@]12O[C@]1([H])C(=O)C(NC(=O)/C=C/C=C/CC(C)C)=C[C@@]2(O)/C=C/C=C/C=C/C(=O)NC1=C(O)CCC1=O
InChIInChI=1S/C27H30N2O7/c1-17(2)10-6-5-8-11-21(32)28-18-16-27(35,26-25(36-26)24(18)34)15-9-4-3-7-12-22(33)29-23-19(30)13-14-20(23)31/h3-9,11-12,15-17,25-26,30,35H,10,13-14H2,1-2H3,(H,28,32)(H,29,33)/b4-3+,6-5+,11-8+,12-7+,15-9+/t25-,26-,27+/m1/s1
InChIKeyNUTSBYCZDOSSIV-FFXBEMEVSA-N
Species of MetaboliteComponentSourceComments
Streptomyces sp. (ncbitaxon:1931) - PubMed (8982334) Strain: E 1511
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
EI-1511-3 (CHEBI:65822) has role anti-inflammatory agent (CHEBI:67079)
EI-1511-3 (CHEBI:65822) has role antibacterial agent (CHEBI:33282)
EI-1511-3 (CHEBI:65822) has role metabolite (CHEBI:25212)
EI-1511-3 (CHEBI:65822) is a cyclic ketone (CHEBI:3992)
EI-1511-3 (CHEBI:65822) is a enamide (CHEBI:51751)
EI-1511-3 (CHEBI:65822) is a enol (CHEBI:33823)
EI-1511-3 (CHEBI:65822) is a epoxide (CHEBI:32955)
EI-1511-3 (CHEBI:65822) is a polyene antibiotic (CHEBI:26177)
EI-1511-3 (CHEBI:65822) is a secondary carboxamide (CHEBI:140325)
EI-1511-3 (CHEBI:65822) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(2E,4E)-N-[(1S,5S,6R)-5-hydroxy-5-{(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)amino]-7-oxohepta-1,3,5-trien-1-yl}-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-7-methylocta-2,4-dienamide
Registry NumbersSources
Reaxys:7630280Reaxys
Citations