basic_info |
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Product_Name: | DEACETYLXYLOPIC ACID |
CAS: | 6619-95-0 |
EnglishSynonyms: | DEACETYLXYLOPIC ACID |
pro_mdlNumber: | MFCD03700714 |
pro_acceptors: | 3 |
pro_donors: | 2 |
pro_smile: | C[C@@]12CCC[C@@](C1CC[C@]34C2CC[C@H](C3)C(=C)[C@H]4O)(C)C(=O)O |
InChi: | InChI=1S/C20H30O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h13-16,21H,1,4-11H2,2-3H3,(H,22,23)/t13?,14?,15?,16-,18-,19-,20-/m1/s1 |
InChiKey: | InChIKey=GVGJRXSJJHLPGZ-OYPHQGFQSA-N |
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