basic_info |
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Product_Name: | 2-(3-HYDROXY-6-OXO-XANTHEN-9-YL)TEREPHTHALIC ACID |
CAS: | 76823-03-5 |
EnglishSynonyms: | 3',6'-DIHYDROXY-3-OXO-3H-SPIRO[ISOBENZOFURAN-1,9'-XANTHENE]-5-CARBOXYLIC ACID ; 2-(3-HYDROXY-6-OXO-XANTHEN-9-YL)TEREPHTHALIC ACID |
pro_mdlNumber: | MFCD00043154 |
pro_acceptors: | 7 |
pro_donors: | 3 |
pro_smile: | c1cc(c(cc1C(=O)O)c2c3ccc(cc3oc-4cc(=O)ccc24)O)C(=O)O |
InChi: | InChI=1S/C21H12O7/c22-11-2-5-14-17(8-11)28-18-9-12(23)3-6-15(18)19(14)16-7-10(20(24)25)1-4-13(16)21(26)27/h1-9,22H,(H,24,25)(H,26,27) |
InChiKey: | InChIKey=YILMHDCPZJTMGI-UHFFFAOYSA-N |
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