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CHEBI:90941 - sibiromycin

ChEBI IDCHEBI:90941
ChEBI Namesibiromycin
Stars
DefinitionAn aminoglycoside antibiotic produced by Streptosporangium sibiricum that also exhibits antitumour properties.
Last Modified3 March 2016
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC24H33N3O7
Net Charge0
Average Mass475.542
Monoisotopic Mass475.23185
SMILES[H][C@@]12CC(/C=C/C)=CN1C(=O)c1cc(O[C@@H]3O[C@@H](C)[C@H](NC)[C@@](C)(O)[C@H]3O)c(C)c(O)c1N[C@@H]2O
InChIInChI=1S/C24H33N3O7/c1-6-7-13-8-15-21(30)26-17-14(22(31)27(15)10-13)9-16(11(2)18(17)28)34-23-20(29)24(4,32)19(25-5)12(3)33-23/h6-7,9-10,12,15,19-21,23,25-26,28-30,32H,8H2,1-5H3/b7-6+/t12-,15-,19-,20-,21+,23-,24+/m0/s1
InChIKeyRAGFPHFDFVNLCG-INYQBOQCSA-N
Species of MetaboliteComponentSourceComments
Streptosporangium sibiricum (ncbitaxon:457432) - PubMed (25960001)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
sibiromycin (CHEBI:90941) has role antineoplastic agent (CHEBI:35610)
sibiromycin (CHEBI:90941) has role bacterial metabolite (CHEBI:76969)
sibiromycin (CHEBI:90941) is a aminoglycoside antibiotic (CHEBI:22507)
sibiromycin (CHEBI:90941) is a hemiaminal (CHEBI:73080)
sibiromycin (CHEBI:90941) is a phenols (CHEBI:33853)
sibiromycin (CHEBI:90941) is a pyrrolobenzodiazepine (CHEBI:131437)
IUPAC Name 
(11R,11aS)-9,11-dihydroxy-8-methyl-5-oxo-2-[(1E)-prop-1-en-1-yl]-5,10,11,11a-tetrahydro-1H-pyrrolo[2,1-][1,4]benzodiazepin-7-yl 4,6-dideoxy-3-C-methyl-4-(methylamino)-α-L-mannopyranoside
Synonym  Source
SybiromycinChemIDplus
Manual XrefsDatabases
CPD-18442MetaCyc
C00018852KNApSAcK
Registry NumbersSources
Reaxys:14751112Reaxys
CAS:12684-33-2KNApSAcK
CAS:12684-33-2ChemIDplus
Citations