EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:223362 - Asparenomycin B

Default Structure
ChEBI IDCHEBI:223362
ChEBI NameAsparenomycin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H18N2O6S
Net Charge0
Average Mass342.373
Monoisotopic Mass342.08856
SMILESCC(=O)NCCS(=O)C1=C(C(=O)O)N2C(=O)/C(=C(\C)CO)C2C1
InChIInChI=1S/C14H18N2O6S/c1-7(6-17)11-9-5-10(23(22)4-3-15-8(2)18)12(14(20)21)16(9)13(11)19/h9,17H,3-6H2,1-2H3,(H,15,18)(H,20,21)/b11-7+
InChIKeyIATDYGCCUJUVGA-YRNVUSSQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7068508)
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
ChEBI Ontology
Outgoing Relation(s)
Asparenomycin B (CHEBI:223362) is a carbapenems (CHEBI:46633)
IUPAC Name 
(6E)-3-(2-acetamidoethylsulinyl)-6-(1-hydroxypropan-2-ylidene)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Manual XrefsDatabases
8242864ChemSpider