EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:220828 - JBIR-20

ChEBI IDCHEBI:220828
ChEBI NameJBIR-20
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H48NO8P
Net Charge0
Average Mass533.643
Monoisotopic Mass533.31175
SMILESCC1CCC/C=C/CCCCCCCCC(O)CC2OC2C(OP(=O)(O)OCCN)CCCC(=O)O1
InChIInChI=1S/C26H48NO8P/c1-21-14-11-9-7-5-3-2-4-6-8-10-12-15-22(28)20-24-26(34-24)23(16-13-17-25(29)33-21)35-36(30,31)32-19-18-27/h5,7,21-24,26,28H,2-4,6,8-20,27H2,1H3,(H,30,31)/b7-5+
InChIKeyLBWZRMONPJHZQE-FNORWQNLSA-N
Species of MetaboliteComponentSourceComments
Metarhizium (ncbitaxon:5529) - PubMed (19198639)
ChEBI Ontology
Outgoing Relation(s)
JBIR-20 (CHEBI:220828) is a macrolide (CHEBI:25106)
IUPAC Name 
2-aminoethyl [(12E)-22-hydroxy-8-methyl-6-oxo-7,25-dioxabicyclo[22.1.0]pentacos-12-en-2-yl] hydrogen phosphate
Manual XrefsDatabases
78444725ChemSpider