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CHEBI:204568 - Coeligiosin B

ChEBI IDCHEBI:204568
ChEBI NameCoeligiosin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H58N4O
Net Charge0
Average Mass610.931
Monoisotopic Mass610.46106
SMILESCCCCCCCCCCCC1=NC(=C(c2nc(-c3cccn3)cc2OC)c2nc3cc2[C@@H](CCCC)CCCCCC3)C=C1
InChIInChI=1S/C40H58N4O/c1-4-6-8-9-10-11-12-13-17-22-31-25-26-35(42-31)38(40-37(45-3)29-36(44-40)34-24-19-27-41-34)39-33-28-32(43-39)23-18-15-14-16-21-30(33)20-7-5-2/h19,24-30,41,43-44H,4-18,20-23H2,1-3H3/t30-/m0/s1
InChIKeyOOHPMURDIUCNIG-PMERELPUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (25760402)
ChEBI Ontology
Outgoing Relation(s)
Coeligiosin B (CHEBI:204568) is a aromatic ether (CHEBI:35618)