CHEBI:80062 - Chivosazole F

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Chivosazole F
ChEBI ID CHEBI:80062
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C41H57NO8
Net Charge 0
Average Mass 691.89320
Monoisotopic Mass 691.40842
InChI InChI=1S/C41H57NO8/c1-28-18-12-8-11-15-23-39(47)50-40(32(5)37(46)25-31(4)43)29(2)19-13-9-10-14-21-35(44)26-38(48-7)33(6)41-42-34(27-49-41)20-16-17-22-36(45)30(3)24-28/h8-24,27,29-33,35-38,40,43-46H,25-26H2,1-7H3/b10-9+,11-8+,18-12-,19-13-,20-16+,21-14+,22-17-,23-15-,28-24+
InChIKey ATQKOUYCGKRYRF-GDDXYXLTSA-N
SMILES COC1CC(O)\C=C\C=C\C=C/C(C)C(OC(=O)\C=C/C=C/C=C\C(C)=C\C(C)C(O)\C=C/C=C/c2coc(n2)C1C)C(C)C(O)CC(C)O
ChEBI Ontology
Outgoing Chivosazole F (CHEBI:80062) is a oxazole (CHEBI:35790)
Manual Xref Database
C15733 KEGG COMPOUND
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