CHEBI:80951 - Fistularin 2

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ChEBI Name Fistularin 2
ChEBI ID CHEBI:80951
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H21Br4N3O8
Net Charge 0
Average Mass 775.03300
Monoisotopic Mass 770.80622
InChI InChI=1S/C22H21Br4N3O8/c1-34-18-13(25)4-22(19(31)16(18)26)5-14(29-37-22)20(32)27-7-15(30)9-2-11(23)17(12(24)3-9)35-8-10-6-28-21(33)36-10/h2-4,10,15,19,30-31H,5-8H2,1H3,(H,27,32)(H,28,33)
InChIKey WKUSHGVKGFQCSJ-UHFFFAOYSA-N
SMILES COC1=C(Br)C(O)C2(CC(=NO2)C(=O)NCC(O)c2cc(Br)c(OCC3CNC(=O)O3)c(Br)c2)C=C1Br
ChEBI Ontology
Outgoing Fistularin 2 (CHEBI:80951) is a aromatic ether (CHEBI:35618)
Manual Xref Database
C17161 KEGG COMPOUND
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Registry Number Type Source
73622-21-6 CAS Registry Number KEGG COMPOUND