Products 90295-66-2
CAS 90295-66-2 is the registry number for Badione A. Offered by: MedChemExpress. Available pack sizes: Get quote.
(2E)-2-[4-[10-[(5E)-5-[carboxy-(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl]-12-hydroxy-3,4-dioxo-2-oxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-7-yl]-3-hydroxy-5-oxofuran-2-ylidene]-2-(4-hydroxyphenyl)acetic acid (CAS 90295-66-2) is a chemical compound with the molecular formula C36H18O16 and a molecular weight of 706.5 g/mol. IUPAC name: (2E)-2-[4-[10-[(5E)-5-[carboxy-(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl]-12-hydroxy-3,4-dioxo-2-oxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-7-yl]-3-hydroxy-5-oxofuran-2-ylidene]-2-(4-hydroxyphenyl)acetic acid. InChIKey: DRKMVSXBACRYHE-WECXDZCISA-N.
| Molecular formula | C36H18O16 |
|---|---|
| Molecular weight | 706.5 g/mol |
| IUPAC name | (2E)-2-[4-[10-[(5E)-5-[carboxy-(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl]-12-hydroxy-3,4-dioxo-2-oxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaen-7-yl]-3-hydroxy-5-oxofuran-2-ylidene]-2-(4-hydroxyphenyl)acetic acid |
| InChIKey | DRKMVSXBACRYHE-WECXDZCISA-N |
| SMILES | C1=CC(=CC=C1/C(=C\2/C(=C(C(=O)O2)C3=CC4=C5C(=C3)C(=O)C(=O)OC5=C(C=C4C6=C(/C(=C(/C7=CC=C(C=C7)O)\C(=O)O)/OC6=O)O)O)O)/C(=O)O)O |
Computed by PubChem (NCBI)
Synonyms:
Badione A, orb3024350