CHEBI:80795 - Atractylodin

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ChEBI Name Atractylodin ChEBI ID CHEBI:80795 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 C13H10O Net Charge 0 Average Mass 182.21790 Monoisotopic Mass 182.07316 InChI InChI=1S/C13H10O/c1-2-3-4-5-6-7-8-10-13-11-9-12-14-13/h2-3,8-12H,1H3/b3-2+,10-8+ InChIKey GRBKWAXRYIITKG-QFMFQGICSA-N SMILES C\C=C\C#CC#C\C=C\c1ccco1 ChEBI Ontology Outgoing Atractylodin (CHEBI:80795) is a furans (CHEBI:24129) Manual Xref Database C16918 KEGG COMPOUND View more database links Registry Number Type Source 55290-63-6 CAS Registry Number KEGG COMPOUND