CHEBI:82585 - Aflatoxin B1-endo-8,9-epoxide

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ChEBI Name Aflatoxin B1-endo-8,9-epoxide ChEBI ID CHEBI:82585 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C17H12O7 Net Charge 0 Average Mass 328.27300 Monoisotopic Mass 328.05830 InChI InChI=1S/C17H12O7/c1-20-7-4-8-11(12-14-17(23-14)24-16(12)21-8)13-10(7)5-2-3-6(18)9(5)15(19)22-13/h4,12,14,16-17H,2-3H2,1H3/t12-,14+,16+,17-/m1/s1 InChIKey KHBXRZGALJGBPA-NQZOLGFYSA-N SMILES COc1cc2O[C@H]3O[C@H]4O[C@H]4[C@H]3c2c2oc(=O)c3C(=O)CCc3c12 ChEBI Ontology Outgoing Aflatoxin B1-endo-8,9-epoxide (CHEBI:82585) is a coumarins (CHEBI:23403) Manual Xref Database C19595 KEGG COMPOUND View more database links Registry Number Type Source 141899-13-0 CAS Registry Number KEGG COMPOUND